N-(2-ethylphenyl)azepane-1-carbothioamide

Systemtic Name: N-(2-ethylphenyl)azepane-1-carbothioamide Openeye Name: N-(2-ethylphenyl)azepane-1-carbothioamide CAS Name: N-(2-ethylphenyl)-1-azepanecarbothioamide IUPAC Name: N-(2-ethylphenyl)azepane-1-carbothioamide Traditional Name: N-(2-ethylphenyl)azepane-1-carbothioamide Formula: C15H22N2S MolecularWeight: 262.41358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCCCCC2

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCCCCC2

InChI

InChI=1S/C15H22N2S/c1-2-13-9-5-6-10-14(13)16-15(18)17-11-7-3-4-8-12-17/h5-6,9-10H,2-4,7-8,11-12H2,1H3,(H,16,18)