N-(2,5-dimethoxyphenyl)azepane-1-carbothioamide

Systemtic Name: N-(2,5-dimethoxyphenyl)azepane-1-carbothioamide Openeye Name: N-(2,5-dimethoxyphenyl)azepane-1-carbothioamide CAS Name: N-(2,5-dimethoxyphenyl)-1-azepanecarbothioamide IUPAC Name: N-(2,5-dimethoxyphenyl)azepane-1-carbothioamide Traditional Name: N-(2,5-dimethoxyphenyl)azepane-1-carbothioamide Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)N2CCCCCC2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)N2CCCCCC2

InChI

InChI=1S/C15H22N2O2S/c1-18-12-7-8-14(19-2)13(11-12)16-15(20)17-9-5-3-4-6-10-17/h7-8,11H,3-6,9-10H2,1-2H3,(H,16,20)