3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one

Systemtic Name: 3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one Openeye Name: 3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one CAS Name: 3-[(1H-1,2,4-triazol-5-ylthio)methyl]-4-quinazolinone IUPAC Name: 3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one Traditional Name: 3-[(1H-1,2,4-triazol-5-ylthio)methyl]quinazolin-4-one Formula: C11H9N5OS MolecularWeight: 259.28706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CSC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CSC3=NC=NN3

InChI

InChI=1S/C11H9N5OS/c17-10-8-3-1-2-4-9(8)13-6-16(10)7-18-11-12-5-14-15-11/h1-6H,7H2,(H,12,14,15)