1-(3-azanyl-1,2,4-triazol-4-yl)-2-(4-methylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(3-azanyl-1,2,4-triazol-4-yl)-2-(4-methylphenyl)sulfanyl-ethanone Openeye Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(p-tolylsulfanyl)ethanone CAS Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-[(4-methylphenyl)thio]ethanone IUPAC Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(4-methylphenyl)sulfanylethanone Traditional Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(p-tolylthio)ethanone Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N2C=NN=C2N

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N2C=NN=C2N

InChI

InChI=1S/C11H12N4OS/c1-8-2-4-9(5-3-8)17-6-10(16)15-7-13-14-11(15)12/h2-5,7H,6H2,1H3,(H2,12,14)