Vitas-M small molecule compound

ethyl 4,5-dimethyl-2-[({[4-methyl-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate

Catalog ID
STK400797
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2C)c2ccccc2C)sc(c1C)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 C21H24N4O3S2 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S2/c1-6-28-20(27)17-13(3)14(4)30-19(17)22-16(26)11-29-21-24-23-18(25(21)5)15-10-8-7-9-12(15)2/h7-10H,6,11H2,1-5H3,(H,22,26)
InChIKey
IDMKHXTYGZCDJI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(N2C)C3=CC=CC=C3C
ethyl45dimethyl2((((4methyl5(2methylphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ethyl45dimethyl2((2((4methyl5(2methylphenyl)124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2(2(4METHYL5(2METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC21H24N4O3S2c162820(27)1713(3)14(4)3019(17)2216(26)112921242318(25(21)5)151087912(15)2h710H611H215H3(H2226)
MFCD02586252
ZINC000019641607
ZINC19641607

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Available files

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