N-[1-(methylcarbamothioyl)-2-oxidanylidene-azepan-3-yl]methanamide

Systemtic Name: N-[1-(methylcarbamothioyl)-2-oxidanylidene-azepan-3-yl]methanamide Openeye Name: N-[1-(methylcarbamothioyl)-2-oxo-azepan-3-yl]formamide CAS Name: N-[1-[methylamino(sulfanylidene)methyl]-2-oxo-3-azepanyl]formamide IUPAC Name: N-[1-(methylcarbamothioyl)-2-oxoazepan-3-yl]formamide Traditional Name: N-[2-keto-1-(methylthiocarbamoyl)azepan-3-yl]formamide Formula: C9H15N3O2S MolecularWeight: 229.2993

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCCCC(C1=O)NC=O

Isomeric SMILES

CNC(=S)N1CCCCC(C1=O)NC=O

InChI

InChI=1S/C9H15N3O2S/c1-10-9(15)12-5-3-2-4-7(8(12)14)11-6-13/h6-7H,2-5H2,1H3,(H,10,15)(H,11,13)