N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-[(2-methylphenyl)methylsulfonyl]propanamide

Systemtic Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-[(2-methylphenyl)methylsulfonyl]propanamide Openeye Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-(o-tolylmethylsulfonyl)propanamide CAS Name: N-[2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl]-3-[(2-methylphenyl)methylsulfonyl]propanamide IUPAC Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-[(2-methylphenyl)methylsulfonyl]propanamide Traditional Name: N-[2-[4-(3-chlorophenyl)piperazino]ethyl]-3-(2-methylbenzyl)sulfonyl-propionamide Formula: C23H30ClN3O3S MolecularWeight: 464.0206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)CCC(=O)NCCN2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)CCC(=O)NCCN2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H30ClN3O3S/c1-19-5-2-3-6-20(19)18-31(29,30)16-9-23(28)25-10-11-26-12-14-27(15-13-26)22-8-4-7-21(24)17-22/h2-8,17H,9-16,18H2,1H3,(H,25,28)