N-(azepan-1-ylcarbothioyl)-2-propoxy-benzamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-2-propoxy-benzamide Openeye Name: N-(azepane-1-carbothioyl)-2-propoxy-benzamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-2-propoxybenzamide IUPAC Name: N-(azepane-1-carbothioyl)-2-propoxybenzamide Traditional Name: N-(azepane-1-carbothioyl)-2-propoxy-benzamide Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NC(=S)N2CCCCCC2

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NC(=S)N2CCCCCC2

InChI

InChI=1S/C17H24N2O2S/c1-2-13-21-15-10-6-5-9-14(15)16(20)18-17(22)19-11-7-3-4-8-12-19/h5-6,9-10H,2-4,7-8,11-13H2,1H3,(H,18,20,22)