3-phenyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-phenyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-phenyl-2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-phenyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylthio]-4-quinazolinone IUPAC Name: 3-phenyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-phenyl-2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylthio]quinazolin-4-one Formula: C23H17N5OS2 MolecularWeight: 443.54398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C23H17N5OS2/c29-21-18-13-7-8-14-19(18)24-23(28(21)17-11-5-2-6-12-17)31-15-20-25-26-22(30)27(20)16-9-3-1-4-10-16/h1-14H,15H2,(H,26,30)