Vitas-M small molecule compound
methyl 2-{[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK423343
SMILES COC(=O)c1c(NC(=O)c2sc3c(c2Cl)ccc(c3)Cl)sc2c1CCC(C2)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 C20H17Cl2NO3S2 MW 454.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2NO3S2/c1-9-3-5-11-13(7-9)28-19(15(11)20(25)26-2)23-18(24)17-16(22)12-6-4-10(21)8-14(12)27-17/h4,6,8-9H,3,5,7H2,1-2H3,(H,23,24)InChIKey
HKWLDOXKTVTXIZ-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl
InChI=1SC20H17Cl2NO3S2c19351113(79)2819(15(11)20(25)262)2318(24)1716(22)126410(21)814(12)2717h4689H357H212H3(H2324)
methyl2(((36dichloro1benzothiophen2yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2((36dichloro1benzothiophene2carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD02056348
ZINC000002088498
ZINC000002088499
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