N-[(4-ethanoyl-1,4-diazepan-1-yl)carbothioyl]furan-2-carboxamide

Systemtic Name: N-[(4-ethanoyl-1,4-diazepan-1-yl)carbothioyl]furan-2-carboxamide Openeye Name: N-(4-acetyl-1,4-diazepane-1-carbothioyl)furan-2-carboxamide CAS Name: N-[(4-acetyl-1,4-diazepan-1-yl)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-(4-acetyl-1,4-diazepane-1-carbothioyl)furan-2-carboxamide Traditional Name: N-(4-acetyl-1,4-diazepane-1-carbothioyl)-2-furamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=S)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=S)NC(=O)C2=CC=CO2

InChI

InChI=1S/C13H17N3O3S/c1-10(17)15-5-3-6-16(8-7-15)13(20)14-12(18)11-4-2-9-19-11/h2,4,9H,3,5-8H2,1H3,(H,14,18,20)