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

Systemtic Name: N-chloranyl-3-(2-methylphenyl)-N-[4-(1-methylpiperazin-2-yl)phenyl]propane-1-sulfonamide Openeye Name: N-chloro-N-[4-(1-methylpiperazin-2-yl)phenyl]-3-(o-tolyl)propane-1-sulfonamide CAS Name: N-chloro-3-(2-methylphenyl)-N-[4-(1-methyl-2-piperazinyl)phenyl]-1-propanesulfonamide IUPAC Name: N-chloro-3-(2-methylphenyl)-N-[4-(1-methylpiperazin-2-yl)phenyl]propane-1-sulfonamide Traditional Name: N-chloro-N-[4-(1-methylpiperazin-2-yl)phenyl]-3-(o-tolyl)propane-1-sulfonamide Formula: C21H28ClN3O2S MolecularWeight: 421.98392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCCS(=O)(=O)N(C2=CC=C(C=C2)C3CNCCN3C)Cl

Isomeric SMILES

CC1=CC=CC=C1CCCS(=O)(=O)N(C2=CC=C(C=C2)C3CNCCN3C)Cl

InChI

InChI=1S/C21H28ClN3O2S/c1-17-6-3-4-7-18(17)8-5-15-28(26,27)25(22)20-11-9-19(10-12-20)21-16-23-13-14-24(21)2/h3-4,6-7,9-12,21,23H,5,8,13-16H2,1-2H3