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

Systemtic Name: 5-methyl-3-(2-methylphenyl)-2-[(2-oxidanylidene-1H-pyrimidin-6-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 5-methyl-3-(o-tolyl)-2-[(2-oxo-1H-pyrimidin-6-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 5-methyl-3-(2-methylphenyl)-2-[[(2-oxo-1H-pyrimidin-6-yl)thio]methyl]-4-quinazolinone IUPAC Name: 5-methyl-3-(2-methylphenyl)-2-[(2-oxo-1H-pyrimidin-6-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 2-[[(2-keto-1H-pyrimidin-6-yl)thio]methyl]-5-methyl-3-(o-tolyl)quinazolin-4-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)CSC4=CC=NC(=O)N4

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)CSC4=CC=NC(=O)N4

InChI

InChI=1S/C21H18N4O2S/c1-13-6-3-4-9-16(13)25-17(12-28-18-10-11-22-21(27)24-18)23-15-8-5-7-14(2)19(15)20(25)26/h3-11H,12H2,1-2H3,(H,22,24,27)