Vitas-M small molecule compound
methyl 5-ethyl-2-[({[5-phenyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK467762
SMILES C=CCn1c(SCC(=O)Nc2sc(cc2C(=O)OC)CC)nnc1c1ccccc1
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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 C21H22N4O3S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S2/c1-4-11-25-18(14-9-7-6-8-10-14)23-24-21(25)29-13-17(26)22-19-16(20(27)28-3)12-15(5-2)30-19/h4,6-10,12H,1,5,11,13H2,2-3H3,(H,22,26)InChIKey
CGXLUOANEPOFFU-UHFFFAOYSA-NSynonyms
CCC1=CC(=C(S1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=C3)C(=O)OC
InChI=1SC21H22N4O3S2c14112518(1497681014)232421(25)291317(26)221916(20(27)283)1215(52)3019h461012H151113H223H3(H2226)
methyl5ethyl2((((5phenyl4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
methyl5ethyl2((2((5phenyl4prop2enyl124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
METHYL5ETHYL2(2(5PHENYL4PROP2ENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD06078291
ZINC000019636777
ZINC19636777
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