4-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]carbonyl-N-cyclopropyl-benzenesulfonamide

Systemtic Name: 4-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]carbonyl-N-cyclopropyl-benzenesulfonamide Openeye Name: 4-[4-(benzothiophen-3-ylmethyl)piperazine-1-carbonyl]-N-cyclopropyl-benzenesulfonamide CAS Name: 4-[[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-oxomethyl]-N-cyclopropylbenzenesulfonamide IUPAC Name: 4-[4-(1-benzothiophen-3-ylmethyl)piperazine-1-carbonyl]-N-cyclopropylbenzenesulfonamide Traditional Name: 4-[4-(benzothiophen-3-ylmethyl)piperazine-1-carbonyl]-N-cyclopropyl-benzenesulfonamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CSC5=CC=CC=C54

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CSC5=CC=CC=C54

InChI

InChI=1S/C23H25N3O3S2/c27-23(17-5-9-20(10-6-17)31(28,29)24-19-7-8-19)26-13-11-25(12-14-26)15-18-16-30-22-4-2-1-3-21(18)22/h1-6,9-10,16,19,24H,7-8,11-15H2