Vitas-M small molecule compound
1-(1-{[5-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl}amino)-2-chlorophenyl]amino}-4,4-dimethyl-1,3-dioxopentan-2-yl)-N-[4-(2-formylhydrazinyl)phenyl]-1H-benzotriazole-5-carboxamide
Catalog ID
STK367655
SMILES O=CNNc1ccc(cc1)NC(=O)c1ccc2c(c1)nnn2C(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 C47H57ClN8O6 MW 865.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C47H57ClN8O6/c1-10-46(6,7)30-15-23-39(34(26-30)47(8,9)11-2)62-24-12-13-40(58)50-33-20-21-35(48)36(27-33)52-44(61)41(42(59)45(3,4)5)56-38-22-14-29(25-37(38)54-55-56)43(60)51-31-16-18-32(19-17-31)53-49-28-57/h14-23,25-28,41,53H,10-13,24H2,1-9H3,(H,InChIKey
RVUGMPHAPFWGTI-UHFFFAOYSA-NSynonyms
1(1((5((4(24BIS(11DIMETHYLPROPYL)PHENOXY)BUTANOYL)AMINO)2CHLOROPHENYL)CARBAMOYL)33DIMETHYL2OXOBUTYL)N(4(2FORMYLHYDRAZINO)PHENYL)1HBENZOTRIAZOLE5CARBOXAMIDE
1(1((5((4(24bis(2methylbutan2yl)phenoxy)butanoyl)amino)2chlorophenyl)amino)44dimethyl13dioxopentan2yl)N(4(2formylhydrazinyl)phenyl)1Hbenzotriazole5carboxamide
1(1(5(4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANOYLAMINO)2CHLOROANILINO)44DIMETHYL13DIOXOPENTAN2YL)N(4(2FORMYLHYDRAZINYL)PHENYL)BENZOTRIAZOLE5CARBOXAMIDE
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)N3C4=C(C=C(C=C4)C(=O)NC5=CC=C(C=C5)NNC=O)N=N3)C(C)(C)CC
InChI=1SC47H57ClN8O6c11046(67)30152339(34(2630)47(89)112)6224121340(58)5033202135(48)36(2733)5244(61)41(42(59)45(34)5)5638221429(2537(38)545556)43(60)5131161832(191731)53492857h142325284153H101324H219H3(H4957)(H5058)(H5160)(H5261)
MFCD00142182
ZINC000150391395
ZINC000150391399
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