N-[2-(4-methoxyphenyl)ethyl]azepane-1-carbothioamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]azepane-1-carbothioamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]azepane-1-carbothioamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-1-azepanecarbothioamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]azepane-1-carbothioamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]azepane-1-carbothioamide Formula: C16H24N2OS MolecularWeight: 292.43956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2OS/c1-19-15-8-6-14(7-9-15)10-11-17-16(20)18-12-4-2-3-5-13-18/h6-9H,2-5,10-13H2,1H3,(H,17,20)