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

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-(4-fluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(4-fluorophenyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-(4-fluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(4-fluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(4-fluorophenyl)-2-thioxo-1H-quinazolin-4-one Formula: C24H18FN3O2S MolecularWeight: 431.482023

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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

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

InChI

InChI=1S/C24H18FN3O2S/c25-18-6-8-19(9-7-18)28-23(30)20-10-5-16(13-21(20)26-24(28)31)22(29)27-12-11-15-3-1-2-4-17(15)14-27/h1-10,13H,11-12,14H2,(H,26,31)