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

Systemtic Name: 3-phenyl-2-[(2-phenyl-1,2,3-triazol-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-phenyl-2-[(2-phenyltriazol-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-phenyl-2-[(2-phenyl-4-triazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-phenyl-2-[(2-phenyltriazol-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-phenyl-2-[(2-phenyltriazol-4-yl)methylthio]quinazolin-4-one Formula: C23H17N5OS MolecularWeight: 411.47898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H17N5OS/c29-22-20-13-7-8-14-21(20)25-23(27(22)18-9-3-1-4-10-18)30-16-17-15-24-28(26-17)19-11-5-2-6-12-19/h1-15H,16H2