Vitas-M small molecule compound
methyl 2-{[(pyridin-2-ylmethyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK436366
SMILES COC(=O)c1c(NC(=S)NCc2ccccn2)sc2c1CCCC2
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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 C17H19N3O2S2 MW 361.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O2S2/c1-22-16(21)14-12-7-2-3-8-13(12)24-15(14)20-17(23)19-10-11-6-4-5-9-18-11/h4-6,9H,2-3,7-8,10H2,1H3,(H2,19,20,23)InChIKey
WMLVVUUNOYIDBA-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=S)NCC3=CC=CC=N3
InChI=1SC17H19N3O2S2c12216(21)1412723813(12)2415(14)2017(23)19101164591811h469H237810H21H3(H2192023)
methyl2(((pyridin2ylmethyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(pyridin2ylmethylcarbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD03944692
ZINC000006288193
ZINC06288193
ZINC6288193
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