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Vitas-M small molecule compound

methyl 4-[(1-{[5-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl}amino)-2-chlorophenyl]amino}-4,4-dimethyl-1,3-dioxopentan-2-yl)oxy]benzoate

Catalog ID
STK396364
SMILES COC(=O)c1ccc(cc1)OC(C(=O)C(C)(C)C)C(=O)Nc1cc(ccc1Cl)NC(=O)CCCOc1ccc(cc1C(CC)(C)C)C(CC)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C41H53ClN2O7 MW 721.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H53ClN2O7/c1-11-40(6,7)27-17-22-33(30(24-27)41(8,9)12-2)50-23-13-14-34(45)43-28-18-21-31(42)32(25-28)44-37(47)35(36(46)39(3,4)5)51-29-19-15-26(16-20-29)38(48)49-10/h15-22,24-25,35H,11-14,23H2,1-10H3,(H,43,45)(H,44,47)
InChIKey
VXCZXLZDXHEWHD-UHFFFAOYSA-N
Synonyms
63217-24-3
4(1(((5((4(24BIS(11DIMETHYLPROPYL)PHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)BENZOICACIDMETHYLESTER
63217243
BENZOICACID4(1(((2CHLORO5((4(24BIS(11DIMETHYLPROPYL)PHENOXY)1OXOBUTYL)AMINO)PHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)METHYLESTER
BENZOICACID4(1(((5((4(24BIS(11DIMETHYLPROPYL)PHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)METHYLESTER
CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)C(=O)OC)C(C)(C)CC
InChI=1SC41H53ClN2O7c11140(67)27172233(30(2427)41(89)122)5023131434(45)4328182131(42)32(2528)4437(47)35(36(46)39(34)5)5129191526(162029)38(48)4910h1522242535H111423H2110H3(H4345)(H4447)
methyl4((1((5((4(24bis(2methylbutan2yl)phenoxy)butanoyl)amino)2chlorophenyl)amino)44dimethyl13dioxopentan2yl)oxy)benzoate
METHYL4(1(((5((4(24BIS(TERTPENTYL)PHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)BENZOATE
METHYL4(1(((5((4(24BISPHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)BENZOATE
METHYL4(1((5(4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANAMIDO)2CHLOROPHENYL)CARBAMOYL)33DIMETHYL2OXOBUTOXY)BENZOATE
METHYL4(1(5(4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANOYLAMINO)2CHLOROANILINO)44DIMETHYL13DIOXOPENTAN2YL)OXYBENZOATE
METHYL4(1(N(5(4(24BIS(11DIMETHYLPROPYL)PHENOXY)BUTANOYLAMINO)2CHLOROPHENYL)CARBAMOYL)33DIMETHYL2OXOBUTOXY)BENZOATE
MFCD00625818
ZINC000004131121
ZINC000004131123

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Available files

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