N-[(4-methylphenyl)methyl]azepane-1-carbothioamide

Systemtic Name: N-[(4-methylphenyl)methyl]azepane-1-carbothioamide Openeye Name: N-(p-tolylmethyl)azepane-1-carbothioamide CAS Name: N-[(4-methylphenyl)methyl]-1-azepanecarbothioamide IUPAC Name: N-[(4-methylphenyl)methyl]azepane-1-carbothioamide Traditional Name: N-(4-methylbenzyl)azepane-1-carbothioamide Formula: C15H22N2S MolecularWeight: 262.41358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2S/c1-13-6-8-14(9-7-13)12-16-15(18)17-10-4-2-3-5-11-17/h6-9H,2-5,10-12H2,1H3,(H,16,18)