Vitas-M small molecule compound
methyl 2-[({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK440505
SMILES C=CCn1c(SCC(=O)Nc2sccc2C(=O)OC)nnc1c1ccco1
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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 C17H16N4O4S2 MW 404.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O4S2/c1-3-7-21-14(12-5-4-8-25-12)19-20-17(21)27-10-13(22)18-15-11(6-9-26-15)16(23)24-2/h3-6,8-9H,1,7,10H2,2H3,(H,18,22)InChIKey
XKNRBADSIXUHCW-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CO3
InChI=1SC17H16N4O4S2c1372114(125482512)192017(21)271013(22)181511(692615)16(23)242h3689H1710H22H3(H1822)
methyl2((((5(furan2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
METHYL2((2((5(FURAN2YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL2(2(5(2FURYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03946156
ZINC000006453245
ZINC06453245
ZINC6453245
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