4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]-N-[phenyl(thiophen-2-yl)methyl]butanamide

Systemtic Name: 4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]-N-[phenyl(thiophen-2-yl)methyl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxo-N-[phenyl(2-thienyl)methyl]butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-4-oxo-N-[phenyl(thiophen-2-yl)methyl]butanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxo-N-[phenyl(thiophen-2-yl)methyl]butanamide Traditional Name: 4-(4-besylpiperazino)-4-keto-N-[phenyl(2-thienyl)methyl]butyramide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O4S2/c29-23(26-25(22-12-7-19-33-22)20-8-3-1-4-9-20)13-14-24(30)27-15-17-28(18-16-27)34(31,32)21-10-5-2-6-11-21/h1-12,19,25H,13-18H2,(H,26,29)