5-(2-methoxy-2-oxidanylidene-ethyl)-6-methyl-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyrimidin-4-olate

Systemtic Name: 5-(2-methoxy-2-oxidanylidene-ethyl)-6-methyl-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyrimidin-4-olate Openeye Name: 2-(2-anilino-2-oxo-ethyl)sulfanyl-5-(2-methoxy-2-oxo-ethyl)-6-methyl-pyrimidin-4-olate CAS Name: 2-[(2-anilino-2-oxoethyl)thio]-5-(2-methoxy-2-oxoethyl)-6-methyl-4-pyrimidinolate IUPAC Name: 2-(2-anilino-2-oxoethyl)sulfanyl-5-(2-methoxy-2-oxoethyl)-6-methylpyrimidin-4-olate Traditional Name: 2-[(2-anilino-2-keto-ethyl)thio]-5-(2-keto-2-methoxy-ethyl)-6-methyl-pyrimidin-4-olate Formula: C16H16N3O4S- MolecularWeight: 346.38094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC(=O)NC2=CC=CC=C2)[O-])CC(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC(=O)NC2=CC=CC=C2)[O-])CC(=O)OC

InChI

InChI=1S/C16H17N3O4S/c1-10-12(8-14(21)23-2)15(22)19-16(17-10)24-9-13(20)18-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,18,20)(H,17,19,22)/p-1