N-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(4-methylbenzoyl)piperazin-1-yl]-2-oxo-1-(p-tolylsulfonyl)ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-1-(4-methylphenyl)sulfonyl-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-(4-methylbenzoyl)piperazin-1-yl]-1-(4-methylphenyl)sulfonyl-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-keto-2-(4-p-toluoylpiperazino)-1-tosyl-ethyl]thiophene-2-carboxamide Formula: C26H27N3O5S2 MolecularWeight: 525.63968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(NC(=O)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(NC(=O)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H27N3O5S2/c1-18-5-9-20(10-6-18)25(31)28-13-15-29(16-14-28)26(32)24(27-23(30)22-4-3-17-35-22)36(33,34)21-11-7-19(2)8-12-21/h3-12,17,24H,13-16H2,1-2H3,(H,27,30)