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

Systemtic Name: 2-methyl-N-naphthalen-2-ylsulfanyl-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline Openeye Name: 2-methyl-N-(2-naphthylsulfanyl)-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]aniline CAS Name: N-[2-methyl-5-[(4-pentyl-1,4-diazepan-1-yl)methyl]phenyl]-2-naphthalenesulfenamide IUPAC Name: 2-methyl-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-methyl-phenyl]-(2-naphthylthio)amine Formula: C28H37N3S MolecularWeight: 447.67848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3S/c1-3-4-7-15-30-16-8-17-31(19-18-30)22-24-12-11-23(2)28(20-24)29-32-27-14-13-25-9-5-6-10-26(25)21-27/h5-6,9-14,20-21,29H,3-4,7-8,15-19,22H2,1-2H3