3-(3-chloranyl-4-fluoranyl-phenyl)-7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(3-chloro-4-fluorophenyl)-7-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(3-chloro-4-fluorophenyl)-7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-thioxo-1H-quinazolin-4-one Formula: C24H17ClFN3O2S MolecularWeight: 465.927083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C24H17ClFN3O2S/c25-19-12-17(6-8-20(19)26)29-23(31)18-7-5-15(11-21(18)27-24(29)32)22(30)28-10-9-14-3-1-2-4-16(14)13-28/h1-8,11-12H,9-10,13H2,(H,27,32)