N-(azepan-1-ylcarbothioyl)-4-propan-2-yloxy-benzamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-4-propan-2-yloxy-benzamide Openeye Name: N-(azepane-1-carbothioyl)-4-isopropoxy-benzamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-4-propan-2-yloxybenzamide IUPAC Name: N-(azepane-1-carbothioyl)-4-propan-2-yloxybenzamide Traditional Name: N-(azepane-1-carbothioyl)-4-isopropoxy-benzamide Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)N2CCCCCC2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)N2CCCCCC2

InChI

InChI=1S/C17H24N2O2S/c1-13(2)21-15-9-7-14(8-10-15)16(20)18-17(22)19-11-5-3-4-6-12-19/h7-10,13H,3-6,11-12H2,1-2H3,(H,18,20,22)