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

Systemtic Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]-4-quinazolinone IUPAC Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]quinazolin-4-one Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=NC(=NN1)SCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C12H11N5OS/c1-8-14-12(16-15-8)19-7-17-6-13-10-5-3-2-4-9(10)11(17)18/h2-6H,7H2,1H3,(H,14,15,16)