4-chloranyl-3-(2-methylphenyl)-N-[4-(1-methylpiperazin-2-yl)phenyl]butane-1-sulfonamide

Systemtic Name: 4-chloranyl-3-(2-methylphenyl)-N-[4-(1-methylpiperazin-2-yl)phenyl]butane-1-sulfonamide Openeye Name: 4-chloro-N-[4-(1-methylpiperazin-2-yl)phenyl]-3-(o-tolyl)butane-1-sulfonamide CAS Name: 4-chloro-3-(2-methylphenyl)-N-[4-(1-methyl-2-piperazinyl)phenyl]-1-butanesulfonamide IUPAC Name: 4-chloro-3-(2-methylphenyl)-N-[4-(1-methylpiperazin-2-yl)phenyl]butane-1-sulfonamide Traditional Name: 4-chloro-N-[4-(1-methylpiperazin-2-yl)phenyl]-3-(o-tolyl)butane-1-sulfonamide Formula: C22H30ClN3O2S MolecularWeight: 436.0105

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCS(=O)(=O)NC2=CC=C(C=C2)C3CNCCN3C)CCl

Isomeric SMILES

CC1=CC=CC=C1C(CCS(=O)(=O)NC2=CC=C(C=C2)C3CNCCN3C)CCl

InChI

InChI=1S/C22H30ClN3O2S/c1-17-5-3-4-6-21(17)19(15-23)11-14-29(27,28)25-20-9-7-18(8-10-20)22-16-24-12-13-26(22)2/h3-10,19,22,24-25H,11-16H2,1-2H3