5-azanyl-3-methylsulfanyl-N-phenyl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-methylsulfanyl-N-phenyl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-methylsulfanyl-N-phenyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-(methylthio)-N-phenyl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-methylsulfanyl-N-phenyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-(methylthio)-N-phenyl-1,2,4-triazole-1-carbothioamide Formula: C10H11N5S2 MolecularWeight: 265.35784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CSC1=NN(C(=N1)N)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C10H11N5S2/c1-17-9-13-8(11)15(14-9)10(16)12-7-5-3-2-4-6-7/h2-6H,1H3,(H,12,16)(H2,11,13,14)