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

Systemtic Name: N-[1-(ethylcarbamothioyl)-2-oxidanylidene-azepan-3-yl]methanamide Openeye Name: N-[1-(ethylcarbamothioyl)-2-oxo-azepan-3-yl]formamide CAS Name: N-[1-[ethylamino(sulfanylidene)methyl]-2-oxo-3-azepanyl]formamide IUPAC Name: N-[1-(ethylcarbamothioyl)-2-oxoazepan-3-yl]formamide Traditional Name: N-[1-(ethylthiocarbamoyl)-2-keto-azepan-3-yl]formamide Formula: C10H17N3O2S MolecularWeight: 243.32588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17N3O2S/c1-2-11-10(16)13-6-4-3-5-8(9(13)15)12-7-14/h7-8H,2-6H2,1H3,(H,11,16)(H,12,14)