5-[(3,4-dichlorophenyl)carbamothioylamino]-1H-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(3,4-dichlorophenyl)carbamothioylamino]-1H-1,2,4-triazole-3-thiolate Openeye Name: 5-[(3,4-dichlorophenyl)carbamothioylamino]-1H-1,2,4-triazole-3-thiolate CAS Name: 5-[[(3,4-dichloroanilino)-sulfanylidenemethyl]amino]-1H-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(3,4-dichlorophenyl)carbamothioylamino]-1H-1,2,4-triazole-3-thiolate Traditional Name: 5-[(3,4-dichlorophenyl)thiocarbamoylamino]-1H-1,2,4-triazole-3-thiolate Formula: C9H6Cl2N5S2- MolecularWeight: 319.21344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=S)NC2=NC(=NN2)[S-])Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=S)NC2=NC(=NN2)[S-])Cl)Cl

InChI

InChI=1S/C9H7Cl2N5S2/c10-5-2-1-4(3-6(5)11)12-8(17)13-7-14-9(18)16-15-7/h1-3H,(H4,12,13,14,15,16,17,18)/p-1