6-methyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]pyrimidin-4-olate Openeye Name: 6-methyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]pyrimidin-4-olate CAS Name: 6-methyl-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]pyrimidin-4-olate Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methylthio]-6-methyl-pyrimidin-4-olate Formula: C14H11N4O2S- MolecularWeight: 299.32774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NC(=O)C3=CC=CC=C3N2)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NC(=O)C3=CC=CC=C3N2)[O-]

InChI

InChI=1S/C14H12N4O2S/c1-8-6-12(19)18-14(15-8)21-7-11-16-10-5-3-2-4-9(10)13(20)17-11/h2-6H,7H2,1H3,(H,15,18,19)(H,16,17,20)/p-1