5-ethyl-4-[(4-methoxyphenyl)carbamothioylamino]-1,2,4-triazole-3-thiolate

Systemtic Name: 5-ethyl-4-[(4-methoxyphenyl)carbamothioylamino]-1,2,4-triazole-3-thiolate Openeye Name: 5-ethyl-4-[(4-methoxyphenyl)carbamothioylamino]-1,2,4-triazole-3-thiolate CAS Name: 5-ethyl-4-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-1,2,4-triazole-3-thiolate IUPAC Name: 5-ethyl-4-[(4-methoxyphenyl)carbamothioylamino]-1,2,4-triazole-3-thiolate Traditional Name: 5-ethyl-4-[(4-methoxyphenyl)thiocarbamoylamino]-1,2,4-triazole-3-thiolate Formula: C12H14N5OS2- MolecularWeight: 308.40246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1NC(=S)NC2=CC=C(C=C2)OC)[S-]

Isomeric SMILES

CCC1=NN=C(N1NC(=S)NC2=CC=C(C=C2)OC)[S-]

InChI

InChI=1S/C12H15N5OS2/c1-3-10-14-15-12(20)17(10)16-11(19)13-8-4-6-9(18-2)7-5-8/h4-7H,3H2,1-2H3,(H,15,20)(H2,13,16,19)/p-1