ethyl 2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[4-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(4-methylpiperidino)sulfonylbenzoyl]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C24H26N2O5S2 MolecularWeight: 486.60364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C

InChI

InChI=1S/C24H26N2O5S2/c1-3-31-24(28)21-19-6-4-5-7-20(19)32-23(21)25-22(27)17-8-10-18(11-9-17)33(29,30)26-14-12-16(2)13-15-26/h4-11,16H,3,12-15H2,1-2H3,(H,25,27)