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

Systemtic Name: N-[2-[4-(2-methylphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-1-(phenylsulfonyl)ethyl]thiophene-2-carboxamide Openeye Name: N-[1-(benzenesulfonyl)-2-[4-(2-methylbenzoyl)piperazin-1-yl]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-(benzenesulfonyl)-2-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(benzenesulfonyl)-2-[4-(2-methylbenzoyl)piperazin-1-yl]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[1-besyl-2-keto-2-(4-o-toluoylpiperazino)ethyl]thiophene-2-carboxamide Formula: C25H25N3O5S2 MolecularWeight: 511.6131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)C(NC(=O)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)C(NC(=O)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O5S2/c1-18-8-5-6-11-20(18)24(30)27-13-15-28(16-14-27)25(31)23(26-22(29)21-12-7-17-34-21)35(32,33)19-9-3-2-4-10-19/h2-12,17,23H,13-16H2,1H3,(H,26,29)