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Vitas-M small molecule compound

propan-2-yl 3-[1-{[5-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl}amino)-2-methoxyphenyl]amino}-3-(4-methoxyphenyl)-1,3-dioxopropan-2-yl]-2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate

Catalog ID
STK379815
SMILES CCC(c1cc(ccc1OCCCC(=O)Nc1ccc(c(c1)NC(=O)C(n1c(=O)[nH]cc1C(=O)OC(C)C)C(=O)c1ccc(cc1)OC)OC)C(CC)(C)C)(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 C44H56N4O9 MW 784.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H56N4O9/c1-11-43(5,6)29-17-21-35(32(24-29)44(7,8)12-2)56-23-13-14-37(49)46-30-18-22-36(55-10)33(25-30)47-40(51)38(39(50)28-15-19-31(54-9)20-16-28)48-34(26-45-42(48)53)41(52)57-27(3)4/h15-22,24-27,38H,11-14,23H2,1-10H3,(H,45,53)(H,46,49)(H,47,5
InChIKey
VVUGGKDAGAIRQJ-UHFFFAOYSA-N
Synonyms

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)OC)NC(=O)C(C(=O)C3=CC=C(C=C3)OC)N4C(=CNC4=O)C(=O)OC(C)C)C(C)(C)CC
CCC(c1cc(ccc1OCCCC(=O)Nc1ccc(c(c1)NC(=O)C(n1c(=O)(nH)cc1C(=O)OC(C)C)C(=O)c1ccc(cc1)OC)OC)C(CC)(C)C)(C)C
InChI=1SC44H56N4O9c11143(56)29172135(32(2429)44(78)122)5623131437(49)4630182236(5510)33(2530)4740(51)38(39(50)28151931(549)201628)4834(264542(48)53)41(52)5727(3)4h1522242738H111423H2110H3(H4553)(H4649)(H4751)
METHYLETHYL3(1(N(5(4(24BIS(11DIMETHYLPROPYL)PHENOXY)BUTANOYLAMINO)2METHOXYPHENYL)CARBAMOYL)2(4METHOXYPHENYL)2OXOETHYL)2OXO4IMIDAZOLINE4CARBOXYLATE
MFCD02067683
propan2yl3(1((5((4(24bis(2methylbutan2yl)phenoxy)butanoyl)amino)2methoxyphenyl)amino)3(4methoxyphenyl)13dioxopropan2yl)2oxo23dihydro1Himidazole4carboxylate
PROPAN2YL3(1(5(4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANOYLAMINO)2METHOXYANILINO)3(4METHOXYPHENYL)13DIOXOPROPAN2YL)2OXO1HIMIDAZOLE4CARBOXYLATE
ZINC000150443298
ZINC000150443305

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Available files

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