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

Systemtic Name: 3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]-4-quinazolinone IUPAC Name: 3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]quinazolin-4-one Formula: C17H13N5OS MolecularWeight: 335.38302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C17H13N5OS/c23-16-13-8-4-5-9-14(13)18-10-22(16)11-24-17-19-15(20-21-17)12-6-2-1-3-7-12/h1-10H,11H2,(H,19,20,21)