2-chloranyl-N-naphthalen-2-ylsulfanyl-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline

Systemtic Name: 2-chloranyl-N-naphthalen-2-ylsulfanyl-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline Openeye Name: 2-chloro-N-(2-naphthylsulfanyl)-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline CAS Name: N-[2-chloro-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]phenyl]-2-naphthalenesulfenamide IUPAC Name: 2-chloro-N-naphthalen-2-ylsulfanyl-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline Traditional Name: [5-[(4-amyl-1,4-diazepan-1-yl)methyl]-2-chloro-phenyl]-(2-naphthylthio)amine Formula: C27H34ClN3S MolecularWeight: 468.09696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCCN(CC1)CC2=CC(=C(C=C2)Cl)NSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCCN1CCCN(CC1)CC2=CC(=C(C=C2)Cl)NSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H34ClN3S/c1-2-3-6-14-30-15-7-16-31(18-17-30)21-22-10-13-26(28)27(19-22)29-32-25-12-11-23-8-4-5-9-24(23)20-25/h4-5,8-13,19-20,29H,2-3,6-7,14-18,21H2,1H3