N-phenyl-N-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propyl]aniline

Systemtic Name: N-phenyl-N-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propyl]aniline Openeye Name: N-phenyl-N-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propyl]aniline CAS Name: N-phenyl-N-[3-[4-[2-(propylthio)phenyl]-1-piperazinyl]propyl]aniline IUPAC Name: N-phenyl-N-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propyl]aniline Traditional Name: diphenyl-[3-[4-[2-(propylthio)phenyl]piperazino]propyl]amine Formula: C28H35N3S MolecularWeight: 445.6626

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=CC=C1N2CCN(CC2)CCCN(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCSC1=CC=CC=C1N2CCN(CC2)CCCN(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H35N3S/c1-2-24-32-28-17-10-9-16-27(28)30-22-20-29(21-23-30)18-11-19-31(25-12-5-3-6-13-25)26-14-7-4-8-15-26/h3-10,12-17H,2,11,18-24H2,1H3