Vitas-M small molecule compound
methyl 3-chloro-6-{[(3-methylpiperidin-1-yl)carbonothioyl]amino}-1-benzothiophene-2-carboxylate
Catalog ID
STK443516
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)N1CCCC(C1)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 C17H19ClN2O2S2 MW 382.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN2O2S2/c1-10-4-3-7-20(9-10)17(23)19-11-5-6-12-13(8-11)24-15(14(12)18)16(21)22-2/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,19,23)InChIKey
HTJMSYMOTOCMNO-UHFFFAOYSA-NSynonyms
CC1CCCN(C1)C(=S)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl
InChI=1SC17H19ClN2O2S2c11043720(910)17(23)1911561213(811)2415(14(12)18)16(21)222h56810H3479H212H3(H1923)
methyl3chloro6(((3methylpiperidin1yl)carbonothioyl)amino)1benzothiophene2carboxylate
METHYL3CHLORO6(((3METHYLPIPERIDYL)THIOXOMETHYL)AMINO)BENZO(B)THIOPHENE2CARBOXYLATE
methyl3chloro6((3methylpiperidine1carbothioyl)amino)1benzothiophene2carboxylate
MFCD04054798
ZINC000006399037
ZINC000006399252
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