methyl 2-[[4-(2-oxidanylidene-1,3-oxazinan-3-yl)piperidin-1-yl]carbothioylamino]ethanoate

Systemtic Name: methyl 2-[[4-(2-oxidanylidene-1,3-oxazinan-3-yl)piperidin-1-yl]carbothioylamino]ethanoate Openeye Name: methyl 2-[[4-(2-oxo-1,3-oxazinan-3-yl)piperidine-1-carbothioyl]amino]acetate CAS Name: 2-[[[4-(2-oxo-1,3-oxazinan-3-yl)-1-piperidinyl]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(2-oxo-1,3-oxazinan-3-yl)piperidine-1-carbothioyl]amino]acetate Traditional Name: 2-[[4-(2-keto-1,3-oxazinan-3-yl)piperidine-1-carbothioyl]amino]acetic acid methyl ester Formula: C13H21N3O4S MolecularWeight: 315.38854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=S)N1CCC(CC1)N2CCCOC2=O

Isomeric SMILES

COC(=O)CNC(=S)N1CCC(CC1)N2CCCOC2=O

InChI

InChI=1S/C13H21N3O4S/c1-19-11(17)9-14-12(21)15-6-3-10(4-7-15)16-5-2-8-20-13(16)18/h10H,2-9H2,1H3,(H,14,21)