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

Systemtic Name: N-[(4-methoxyphenyl)methyl]azepane-1-carbothioamide Openeye Name: N-[(4-methoxyphenyl)methyl]azepane-1-carbothioamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-azepanecarbothioamide IUPAC Name: N-[(4-methoxyphenyl)methyl]azepane-1-carbothioamide Traditional Name: N-p-anisylazepane-1-carbothioamide Formula: C15H22N2OS MolecularWeight: 278.41298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N2CCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N2CCCCCC2

InChI

InChI=1S/C15H22N2OS/c1-18-14-8-6-13(7-9-14)12-16-15(19)17-10-4-2-3-5-11-17/h6-9H,2-5,10-12H2,1H3,(H,16,19)