6-methyl-5-(4-methylphenyl)-2-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(4-methylphenyl)-2-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-allyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-6-methyl-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-5-(4-methylphenyl)-2-[[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-5-(4-methylphenyl)-2-[(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(3-allyl-4-keto-quinazolin-2-yl)thio]methyl]-6-methyl-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C26H22N4O2S2 MolecularWeight: 486.60848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NC5=CC=CC=C5C(=O)N4CC=C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NC5=CC=CC=C5C(=O)N4CC=C)C

InChI

InChI=1S/C26H22N4O2S2/c1-4-13-30-25(32)18-7-5-6-8-19(18)27-26(30)33-14-20-28-23(31)22-21(16(3)34-24(22)29-20)17-11-9-15(2)10-12-17/h4-12H,1,13-14H2,2-3H3,(H,28,29,31)