2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-oxidanylidene-3-phenyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-oxidanylidene-3-phenyl-pyrimidin-4-olate Openeye Name: 2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-5-ethyl-6-oxo-3-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-(diethylamino)-2-oxoethyl]thio]-5-ethyl-6-oxo-3-phenyl-4-pyrimidinolate IUPAC Name: 2-[2-(diethylamino)-2-oxoethyl]sulfanyl-5-ethyl-6-oxo-3-phenylpyrimidin-4-olate Traditional Name: 2-[[2-(diethylamino)-2-keto-ethyl]thio]-5-ethyl-6-keto-3-phenyl-pyrimidin-4-olate Formula: C18H22N3O3S- MolecularWeight: 360.45058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)N(CC)CC)C2=CC=CC=C2)[O-]

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)N(CC)CC)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C18H23N3O3S/c1-4-14-16(23)19-18(25-12-15(22)20(5-2)6-3)21(17(14)24)13-10-8-7-9-11-13/h7-11,24H,4-6,12H2,1-3H3/p-1