N-[(5-ethyl-1H-1,2,4-triazol-3-yl)carbamothioyl]benzamide

Systemtic Name: N-[(5-ethyl-1H-1,2,4-triazol-3-yl)carbamothioyl]benzamide Openeye Name: N-[(5-ethyl-1H-1,2,4-triazol-3-yl)carbamothioyl]benzamide CAS Name: N-[[(5-ethyl-1H-1,2,4-triazol-3-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(5-ethyl-1H-1,2,4-triazol-3-yl)carbamothioyl]benzamide Traditional Name: N-[(5-ethyl-1H-1,2,4-triazol-3-yl)thiocarbamoyl]benzamide Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC1=NC(=NN1)NC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H13N5OS/c1-2-9-13-11(17-16-9)15-12(19)14-10(18)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H3,13,14,15,16,17,18,19)