Vitas-M small molecule compound
methyl 3-{[N-(4-bromo-3-methylphenyl)-N-(methylsulfonyl)glycyl]amino}-4-methylbenzoate
Catalog ID
STK357717
SMILES COC(=O)c1ccc(c(c1)NC(=O)CN(S(=O)(=O)C)c1ccc(c(c1)C)Br)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 C19H21BrN2O5S MW 469.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrN2O5S/c1-12-5-6-14(19(24)27-3)10-17(12)21-18(23)11-22(28(4,25)26)15-7-8-16(20)13(2)9-15/h5-10H,11H2,1-4H3,(H,21,23)InChIKey
ABIZKCZBHXFVLS-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C2=CC(=C(C=C2)Br)C)S(=O)(=O)C
InChI=1SC19H21BrN2O5Sc1125614(19(24)273)1017(12)2118(23)1122(28(425)26)157816(20)13(2)915h510H11H214H3(H2123)
METHYL3((2(4BROMO3METHYLNMETHYLSULFONYLANILINO)ACETYL)AMINO)4METHYLBENZOATE
METHYL3((N(4BROMO3METHYLPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)4METHYLBENZOATE
MFCD06631935
ZINC000016347392
ZINC16347392
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