3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]-4-quinazolinone IUPAC Name: 3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]quinazolin-4-one Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCN2C=NC3=CC=CC=C3C2=O

InChI

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