5-chloranyl-2-(4-methylphenyl)sulfanyl-N-[3-(4-methylpiperazin-1-yl)propyl]aniline

Systemtic Name: 5-chloranyl-2-(4-methylphenyl)sulfanyl-N-[3-(4-methylpiperazin-1-yl)propyl]aniline Openeye Name: 5-chloro-N-[3-(4-methylpiperazin-1-yl)propyl]-2-(p-tolylsulfanyl)aniline CAS Name: 5-chloro-2-[(4-methylphenyl)thio]-N-[3-(4-methyl-1-piperazinyl)propyl]aniline IUPAC Name: 5-chloro-2-(4-methylphenyl)sulfanyl-N-[3-(4-methylpiperazin-1-yl)propyl]aniline Traditional Name: [5-chloro-2-(p-tolylthio)phenyl]-[3-(4-methylpiperazino)propyl]amine Formula: C21H28ClN3S MolecularWeight: 389.98512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)Cl)NCCCN3CCN(CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)Cl)NCCCN3CCN(CC3)C

InChI

InChI=1S/C21H28ClN3S/c1-17-4-7-19(8-5-17)26-21-9-6-18(22)16-20(21)23-10-3-11-25-14-12-24(2)13-15-25/h4-9,16,23H,3,10-15H2,1-2H3