N-(3-carbamothioylphenyl)-2-(2-oxidanylideneazepan-1-yl)ethanamide

Systemtic Name: N-(3-carbamothioylphenyl)-2-(2-oxidanylideneazepan-1-yl)ethanamide Openeye Name: N-(3-carbamothioylphenyl)-2-(2-oxoazepan-1-yl)acetamide CAS Name: N-(3-carbamothioylphenyl)-2-(2-oxo-1-azepanyl)acetamide IUPAC Name: N-(3-carbamothioylphenyl)-2-(2-oxoazepan-1-yl)acetamide Traditional Name: 2-(2-ketoazepan-1-yl)-N-(3-thiocarbamoylphenyl)acetamide Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NC2=CC=CC(=C2)C(=S)N

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C15H19N3O2S/c16-15(21)11-5-4-6-12(9-11)17-13(19)10-18-8-3-1-2-7-14(18)20/h4-6,9H,1-3,7-8,10H2,(H2,16,21)(H,17,19)