3-(4-fluorophenyl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-(4-fluorophenyl)-2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(4-fluorophenyl)-2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]quinazolin-4-one Formula: C28H23FN2O3S MolecularWeight: 486.557223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F)C(C)C

InChI

InChI=1S/C28H23FN2O3S/c1-16(2)22-14-23-18(13-26(32)34-25(23)12-17(22)3)15-35-28-30-24-7-5-4-6-21(24)27(33)31(28)20-10-8-19(29)9-11-20/h4-14,16H,15H2,1-3H3