Vitas-M small molecule compound
ethyl 5-carbamoyl-4-methyl-2-[({[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK467601
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2C)c2cccnc2)sc(c1C)C(=O)N
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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 C19H20N6O4S2 MW 460.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O4S2/c1-4-29-18(28)13-10(2)14(15(20)27)31-17(13)22-12(26)9-30-19-24-23-16(25(19)3)11-6-5-7-21-8-11/h5-8H,4,9H2,1-3H3,(H2,20,27)(H,22,26)InChIKey
WQCSWIMPUXAQKU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CSC2=NN=C(N2C)C3=CN=CC=C3
ethyl5carbamoyl4methyl2((((4methyl5(pyridin3yl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ethyl5carbamoyl4methyl2((2((4methyl5pyridin3yl124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ETHYL5CARBAMOYL4METHYL2(2(4METHYL5(3PYRIDYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC19H20N6O4S2c142918(28)1310(2)14(15(20)27)3117(13)2212(26)93019242316(25(19)3)1165721811h58H49H213H3(H22027)(H2226)
MFCD06105645
ZINC000020168073
ZINC20168073
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