Vitas-M small molecule compound
ethyl 2-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK122581
SMILES CCOC(=O)c1c(NC(=O)CSc2nc3c([nH]2)cccc3)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 C20H21N3O3S2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S2/c1-2-26-19(25)17-12-7-3-6-10-15(12)28-18(17)23-16(24)11-27-20-21-13-8-4-5-9-14(13)22-20/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H,21,22)(H,23,24)InChIKey
GMYCGQTZBBVGLD-UHFFFAOYSA-NSynonyms
326018-80-8326018808
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC4=CC=CC=C4N3
CCOC(=O)c1c(NC(=O)CSc2nc3c((nH)2)cccc3)sc2c1CCCC2
ethyl2(((1Hbenzimidazol2ylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(1Hbenzimidazol2ylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(2((1Hbenzo(d)imidazol2yl)thio)acetamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC20H21N3O3S2c122619(25)17127361015(12)2818(17)2316(24)1127202113845914(13)2220h4589H23671011H21H3(H2122)(H2324)
MFCD00296184
ZINC000000853568
ZINC00853568
ZINC853568
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