2-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate Openeye Name: 2-[2-(3-acetylanilino)-2-oxo-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-(3-acetylanilino)-2-oxoethyl]thio]-6-phenyl-4-pyrimidinolate IUPAC Name: 2-[2-(3-acetylanilino)-2-oxoethyl]sulfanyl-6-phenylpyrimidin-4-olate Traditional Name: 2-[[2-(3-acetylanilino)-2-keto-ethyl]thio]-6-phenyl-pyrimidin-4-olate Formula: C20H16N3O3S- MolecularWeight: 378.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=CC(=N2)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=CC(=N2)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O3S/c1-13(24)15-8-5-9-16(10-15)21-19(26)12-27-20-22-17(11-18(25)23-20)14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H,21,26)(H,22,23,25)/p-1