5-ethyl-6-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-phenyl-pyrimidin-4-olate

Systemtic Name: 5-ethyl-6-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-phenyl-pyrimidin-4-olate Openeye Name: 5-ethyl-6-oxo-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-3-phenyl-pyrimidin-4-olate CAS Name: 5-ethyl-6-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-phenyl-4-pyrimidinolate IUPAC Name: 5-ethyl-6-oxo-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-3-phenylpyrimidin-4-olate Traditional Name: 5-ethyl-6-keto-2-[(2-keto-2-piperidino-ethyl)thio]-3-phenyl-pyrimidin-4-olate Formula: C19H22N3O3S- MolecularWeight: 372.46128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)N2CCCCC2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)N2CCCCC2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C19H23N3O3S/c1-2-15-17(24)20-19(22(18(15)25)14-9-5-3-6-10-14)26-13-16(23)21-11-7-4-8-12-21/h3,5-6,9-10,25H,2,4,7-8,11-13H2,1H3/p-1