Vitas-M small molecule compound

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

Catalog ID
STK483374
SMILES COC(=O)c1ccsc1NC(=O)CSc1nncn1C

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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 C11H12N4O3S2 MW 312.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4O3S2/c1-15-6-12-14-11(15)20-5-8(16)13-9-7(3-4-19-9)10(17)18-2/h3-4,6H,5H2,1-2H3,(H,13,16)
InChIKey
HLYMPWBKUOLKGK-UHFFFAOYSA-N
Synonyms

CN1C=NN=C1SCC(=O)NC2=C(C=CS2)C(=O)OC
InChI=1SC11H12N4O3S2c1156121411(15)2058(16)1397(34199)10(17)182h346H5H212H3(H1316)
methyl2((((4methyl4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
methyl2((2((4methyl124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
METHYL2(2(4METHYL124TRIAZOL3YLTHIO)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD06145867
ZINC000013324222
ZINC13324222

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.