N-[(2-ethyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[(2-ethyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[(2-ethyltetrazol-5-yl)carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[(2-ethyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[(2-ethyltetrazol-5-yl)carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[(2-ethyltetrazol-5-yl)thiocarbamoyl]-2-phenoxy-acetamide Formula: C12H14N6O2S MolecularWeight: 306.34356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1N=C(N=N1)NC(=S)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCN1N=C(N=N1)NC(=S)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C12H14N6O2S/c1-2-18-16-11(15-17-18)14-12(21)13-10(19)8-20-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,13,14,16,19,21)