5-azanyl-N-methyl-3-(4-methylphenyl)-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-N-methyl-3-(4-methylphenyl)-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-N-methyl-3-(p-tolyl)-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-N-methyl-3-(4-methylphenyl)-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-N-methyl-3-(4-methylphenyl)-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-N-methyl-3-(p-tolyl)-1,2,4-triazole-1-carbothioamide Formula: C11H13N5S MolecularWeight: 247.31942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)N)C(=S)NC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)N)C(=S)NC

InChI

InChI=1S/C11H13N5S/c1-7-3-5-8(6-4-7)9-14-10(12)16(15-9)11(17)13-2/h3-6H,1-2H3,(H,13,17)(H2,12,14,15)