1-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-[(4-keto-1H-quinazolin-2-yl)methylthio]-4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C24H16N6O2S MolecularWeight: 452.48784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC5=NC(=O)C6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC5=NC(=O)C6=CC=CC=C6N5

InChI

InChI=1S/C24H16N6O2S/c31-21-16-10-4-6-12-18(16)25-20(26-21)14-33-24-28-27-23-29(15-8-2-1-3-9-15)22(32)17-11-5-7-13-19(17)30(23)24/h1-13H,14H2,(H,25,26,31)