3-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2-thioxo-1H-quinazolin-4-one Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5NC4=S

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5NC4=S

InChI

InChI=1S/C24H19N3O2S/c28-22(26-14-13-16-5-1-2-6-18(16)15-26)17-9-11-19(12-10-17)27-23(29)20-7-3-4-8-21(20)25-24(27)30/h1-12H,13-15H2,(H,25,30)