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

Systemtic Name: 2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinazolin-4-one Openeye Name: 2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinazolin-4-one CAS Name: 2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-quinazolin-4-one IUPAC Name: 2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinazolin-4-one Traditional Name: 2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-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/c17-10-7-3-1-2-4-8(7)14-9(15-10)5-18-11-12-6-13-16-11/h1-4,6H,5H2,(H,12,13,16)(H,14,15,17)