2-[[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[7-chloro-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[[7-chloro-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[7-chloro-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[[7-chloro-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C22H15ClN4O2S2 MolecularWeight: 466.9631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C22H15ClN4O2S2/c1-12-3-2-4-14(9-12)27-21(29)15-6-5-13(23)10-17(15)25-22(27)31-11-18-24-16-7-8-30-19(16)20(28)26-18/h2-10H,11H2,1H3,(H,24,26,28)