4-bromanyl-N-naphthalen-2-ylsulfanyl-3-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline

Systemtic Name: 4-bromanyl-N-naphthalen-2-ylsulfanyl-3-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline Openeye Name: 4-bromo-N-(2-naphthylsulfanyl)-3-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline CAS Name: N-[4-bromo-3-[(4-pentyl-1,4-diazepan-1-yl)methyl]phenyl]-2-naphthalenesulfenamide IUPAC Name: 4-bromo-N-naphthalen-2-ylsulfanyl-3-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline Traditional Name: [3-[(4-amyl-1,4-diazepan-1-yl)methyl]-4-bromo-phenyl]-(2-naphthylthio)amine Formula: C27H34BrN3S MolecularWeight: 512.54796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34BrN3S/c1-2-3-6-14-30-15-7-16-31(18-17-30)21-24-19-25(11-13-27(24)28)29-32-26-12-10-22-8-4-5-9-23(22)20-26/h4-5,8-13,19-20,29H,2-3,6-7,14-18,21H2,1H3