N-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[2-[4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[2-[4-(3-methylphenyl)-1-piperazinyl]-2-oxoethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[2-keto-2-[4-(m-tolyl)piperazino]ethyl]phenyl]thiophene-2-sulfonamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H25N3O3S2/c1-18-4-2-5-21(16-18)25-11-13-26(14-12-25)22(27)17-19-7-9-20(10-8-19)24-31(28,29)23-6-3-15-30-23/h2-10,15-16,24H,11-14,17H2,1H3