5-azanyl-N-methyl-3-pyridin-4-yl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-N-methyl-3-pyridin-4-yl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-N-methyl-3-(4-pyridyl)-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-N-methyl-3-pyridin-4-yl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-N-methyl-3-pyridin-4-yl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-N-methyl-3-(4-pyridyl)-1,2,4-triazole-1-carbothioamide Formula: C9H10N6S MolecularWeight: 234.2809

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(=NC(=N1)C2=CC=NC=C2)N

Isomeric SMILES

CNC(=S)N1C(=NC(=N1)C2=CC=NC=C2)N

InChI

InChI=1S/C9H10N6S/c1-11-9(16)15-8(10)13-7(14-15)6-2-4-12-5-3-6/h2-5H,1H3,(H,11,16)(H2,10,13,14)