3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-N,N-diethyl-4-methyl-benzenesulfonamide

Systemtic Name: 3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-N,N-diethyl-4-methyl-benzenesulfonamide Openeye Name: 3-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-N,N-diethyl-4-methyl-benzenesulfonamide CAS Name: 3-[[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-oxomethyl]-N,N-diethyl-4-methylbenzenesulfonamide IUPAC Name: 3-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-N,N-diethyl-4-methylbenzenesulfonamide Traditional Name: 3-[4-(3-chlorobenzyl)piperazine-1-carbonyl]-N,N-diethyl-4-methyl-benzenesulfonamide Formula: C23H30ClN3O3S MolecularWeight: 464.0206

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H30ClN3O3S/c1-4-27(5-2)31(29,30)21-10-9-18(3)22(16-21)23(28)26-13-11-25(12-14-26)17-19-7-6-8-20(24)15-19/h6-10,15-16H,4-5,11-14,17H2,1-3H3