2-[[3-[2,4-bis(fluoranyl)phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[3-[2,4-bis(fluoranyl)phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[[3-(2,4-difluorophenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[[[3-(2,4-difluorophenyl)-4-oxo-2-quinazolinyl]thio]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[3-(2,4-difluorophenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[3-(2,4-difluorophenyl)-4-keto-quinazolin-2-yl]thio]methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C25H18F2N4O2S2 MolecularWeight: 508.562826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)CSC4=NC5=CC=CC=C5C(=O)N4C6=C(C=C(C=C6)F)F

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)CSC4=NC5=CC=CC=C5C(=O)N4C6=C(C=C(C=C6)F)F

InChI

InChI=1S/C25H18F2N4O2S2/c26-13-9-10-18(16(27)11-13)31-24(33)14-5-1-3-7-17(14)28-25(31)34-12-20-29-22(32)21-15-6-2-4-8-19(15)35-23(21)30-20/h1,3,5,7,9-11H,2,4,6,8,12H2,(H,29,30,32)