N-(2,6-dimethylheptan-4-yl)-3-methylsulfanyl-aniline

Systemtic Name: N-(2,6-dimethylheptan-4-yl)-3-methylsulfanyl-aniline Openeye Name: N-(1-isobutyl-3-methyl-butyl)-3-methylsulfanyl-aniline CAS Name: N-(2,6-dimethylheptan-4-yl)-3-(methylthio)aniline IUPAC Name: N-(2,6-dimethylheptan-4-yl)-3-methylsulfanylaniline Traditional Name: (1-isobutyl-3-methyl-butyl)-[3-(methylthio)phenyl]amine Formula: C16H27NS MolecularWeight: 265.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C)C)NC1=CC(=CC=C1)SC

Isomeric SMILES

CC(C)CC(CC(C)C)NC1=CC(=CC=C1)SC

InChI

InChI=1S/C16H27NS/c1-12(2)9-15(10-13(3)4)17-14-7-6-8-16(11-14)18-5/h6-8,11-13,15,17H,9-10H2,1-5H3