4-[3-[4-(3-methylphenyl)piperazin-1-yl]propylsulfanyl]aniline

Systemtic Name: 4-[3-[4-(3-methylphenyl)piperazin-1-yl]propylsulfanyl]aniline Openeye Name: 4-[3-[4-(m-tolyl)piperazin-1-yl]propylsulfanyl]aniline CAS Name: 4-[3-[4-(3-methylphenyl)-1-piperazinyl]propylthio]aniline IUPAC Name: 4-[3-[4-(3-methylphenyl)piperazin-1-yl]propylsulfanyl]aniline Traditional Name: [4-[3-[4-(m-tolyl)piperazino]propylthio]phenyl]amine Formula: C20H27N3S MolecularWeight: 341.51348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCSC3=CC=C(C=C3)N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCSC3=CC=C(C=C3)N

InChI

InChI=1S/C20H27N3S/c1-17-4-2-5-19(16-17)23-13-11-22(12-14-23)10-3-15-24-20-8-6-18(21)7-9-20/h2,4-9,16H,3,10-15,21H2,1H3