4-chloranyl-N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-3-methylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-3-methylsulfonyl-benzamide Openeye Name: 4-chloro-3-methylsulfonyl-N-[2-[4-(m-tolyl)piperazin-1-yl]ethyl]benzamide CAS Name: 4-chloro-N-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-3-methylsulfonylbenzamide IUPAC Name: 4-chloro-N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-3-methylsulfonylbenzamide Traditional Name: 4-chloro-3-mesyl-N-[2-[4-(m-tolyl)piperazino]ethyl]benzamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26ClN3O3S/c1-16-4-3-5-18(14-16)25-12-10-24(11-13-25)9-8-23-21(26)17-6-7-19(22)20(15-17)29(2,27)28/h3-7,14-15H,8-13H2,1-2H3,(H,23,26)