2-[[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C25H22N4O2S2 MolecularWeight: 474.59778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=C(C(=C(S5)C)C)C(=O)N4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=C(C(=C(S5)C)C)C(=O)N4

InChI

InChI=1S/C25H22N4O2S2/c1-4-16-9-11-17(12-10-16)29-24(31)18-7-5-6-8-19(18)26-25(29)32-13-20-27-22(30)21-14(2)15(3)33-23(21)28-20/h5-12H,4,13H2,1-3H3,(H,27,28,30)