potassium 1-(3-methoxyphenyl)-6-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,3-diazinan-4-olate

Systemtic Name: potassium 1-(3-methoxyphenyl)-6-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,3-diazinan-4-olate Openeye Name: potassium 1-(3-methoxyphenyl)-6-oxo-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-hexahydropyrimidin-4-olate CAS Name: potassium 1-(3-methoxyphenyl)-6-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1,3-diazinan-4-olate IUPAC Name: potassium 1-(3-methoxyphenyl)-6-oxo-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,3-diazinan-4-olate Traditional Name: potassium 6-keto-2-[(2-keto-2-piperidino-ethyl)thio]-1-(3-methoxyphenyl)hexahydropyrimidin-4-olate Formula: C18H24KN3O4S MolecularWeight: 417.56416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(NC(CC2=O)[O-])SCC(=O)N3CCCCC3.[K+]

Isomeric SMILES

COC1=CC=CC(=C1)N2C(NC(CC2=O)[O-])SCC(=O)N3CCCCC3.[K+]

InChI

InChI=1S/C18H24N3O4S.K/c1-25-14-7-5-6-13(10-14)21-16(23)11-15(22)19-18(21)26-12-17(24)20-8-3-2-4-9-20;/h5-7,10,15,18-19H,2-4,8-9,11-12H2,1H3;/q-1;+1