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

Systemtic Name: 2-methyl-N-naphthalen-2-ylsulfanyl-5-[(4-propyl-1,4-diazepan-1-yl)methyl]aniline Openeye Name: 2-methyl-N-(2-naphthylsulfanyl)-5-[(4-propyl-1,4-diazepan-1-yl)methyl]aniline CAS Name: N-[2-methyl-5-[(4-propyl-1,4-diazepan-1-yl)methyl]phenyl]-2-naphthalenesulfenamide IUPAC Name: 2-methyl-N-naphthalen-2-ylsulfanyl-5-[(4-propyl-1,4-diazepan-1-yl)methyl]aniline Traditional Name: [2-methyl-5-[(4-propyl-1,4-diazepan-1-yl)methyl]phenyl]-(2-naphthylthio)amine Formula: C26H33N3S MolecularWeight: 419.62532

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCN(CC1)CC2=CC(=C(C=C2)C)NSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCN1CCCN(CC1)CC2=CC(=C(C=C2)C)NSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H33N3S/c1-3-13-28-14-6-15-29(17-16-28)20-22-10-9-21(2)26(18-22)27-30-25-12-11-23-7-4-5-8-24(23)19-25/h4-5,7-12,18-19,27H,3,6,13-17,20H2,1-2H3