N-(phenylmethyl)-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide hydrochloride

Systemtic Name: N-(phenylmethyl)-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide hydrochloride Openeye Name: N-benzyl-3-(4-benzylpiperazine-1-carbonyl)benzenesulfonamide hydrochloride CAS Name: 3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-N-(phenylmethyl)benzenesulfonamide hydrochloride IUPAC Name: N-benzyl-3-(4-benzylpiperazine-1-carbonyl)benzenesulfonamide hydrochloride Traditional Name: N-benzyl-3-(4-benzylpiperazine-1-carbonyl)benzenesulfonamide hydrochloride Formula: C25H28ClN3O3S MolecularWeight: 486.02612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4.Cl

InChI

InChI=1S/C25H27N3O3S.ClH/c29-25(28-16-14-27(15-17-28)20-22-10-5-2-6-11-22)23-12-7-13-24(18-23)32(30,31)26-19-21-8-3-1-4-9-21;/h1-13,18,26H,14-17,19-20H2;1H