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

Systemtic Name: N-[(2-ethyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(2-ethyltetrazol-5-yl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[(2-ethyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(2-ethyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(2-ethyltetrazol-5-yl)thiocarbamoyl]coumarilamide Formula: C13H12N6O2S MolecularWeight: 316.33838

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Descriptors Computed from Structure

Canonical SMILES:

CCN1N=C(N=N1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCN1N=C(N=N1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C13H12N6O2S/c1-2-19-17-12(16-18-19)15-13(22)14-11(20)10-7-8-5-3-4-6-9(8)21-10/h3-7H,2H2,1H3,(H2,14,15,17,20,22)