1-(azepan-1-yl)-2-methyl-2-(4-methylphenyl)propane-1-thione

Systemtic Name: 1-(azepan-1-yl)-2-methyl-2-(4-methylphenyl)propane-1-thione Openeye Name: 1-(azepan-1-yl)-2-methyl-2-(p-tolyl)propane-1-thione CAS Name: 1-(1-azepanyl)-2-methyl-2-(4-methylphenyl)-1-propanethione IUPAC Name: 1-(azepan-1-yl)-2-methyl-2-(4-methylphenyl)propane-1-thione Traditional Name: 1-(azepan-1-yl)-2-methyl-2-(p-tolyl)propane-1-thione Formula: C17H25NS MolecularWeight: 275.4521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)(C)C(=S)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)C(C)(C)C(=S)N2CCCCCC2

InChI

InChI=1S/C17H25NS/c1-14-8-10-15(11-9-14)17(2,3)16(19)18-12-6-4-5-7-13-18/h8-11H,4-7,12-13H2,1-3H3