N-[4-[4-(3-aminophenyl)piperazin-1-yl]butyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[4-(3-aminophenyl)piperazin-1-yl]butyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[4-(3-aminophenyl)piperazin-1-yl]butyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[4-(3-aminophenyl)-1-piperazinyl]butyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[4-(3-aminophenyl)piperazin-1-yl]butyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[4-(3-aminophenyl)piperazino]butyl]-4-methyl-benzenesulfonamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCN2CCN(CC2)C3=CC(=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCN2CCN(CC2)C3=CC(=CC=C3)N

InChI

InChI=1S/C21H30N4O2S/c1-18-7-9-21(10-8-18)28(26,27)23-11-2-3-12-24-13-15-25(16-14-24)20-6-4-5-19(22)17-20/h4-10,17,23H,2-3,11-16,22H2,1H3