Vitas-M small molecule compound
methyl 5-carbamoyl-2-[({4-[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl}acetyl)amino]-4-methylthiophene-3-carboxylate
Catalog ID
STK467514
SMILES COC(=O)c1c(NC(=O)CN2CCN(CC2)C(=O)c2sc3c(c2Cl)ccc(c3)Cl)sc(c1C)C(=O)N
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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 C23H22Cl2N4O5S2 MW 569.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22Cl2N4O5S2/c1-11-16(23(33)34-2)21(36-18(11)20(26)31)27-15(30)10-28-5-7-29(8-6-28)22(32)19-17(25)13-4-3-12(24)9-14(13)35-19/h3-4,9H,5-8,10H2,1-2H3,(H2,26,31)(H,27,30)InChIKey
QVWXPMXRJLRMAZ-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)C(=O)N
InChI=1SC23H22Cl2N4O5S2c11116(23(33)342)21(3618(11)20(26)31)2715(30)10285729(8628)22(32)1917(25)134312(24)914(13)3519h349H5810H212H3(H22631)(H2730)
methyl5carbamoyl2(((4((36dichloro1benzothiophen2yl)carbonyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
methyl5carbamoyl2((2(4(36dichloro1benzothiophene2carbonyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
MFCD06053113
ZINC000097948427
ZINC97948427
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