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

Systemtic Name: N-[(2-ethyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[(2-ethyltetrazol-5-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[[(2-ethyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[(2-ethyltetrazol-5-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[(2-ethyltetrazol-5-yl)thiocarbamoyl]-5-(2-nitrophenyl)-2-furamide Formula: C15H13N7O4S MolecularWeight: 387.37322

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Descriptors Computed from Structure

Canonical SMILES:

CCN1N=C(N=N1)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN1N=C(N=N1)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H13N7O4S/c1-2-21-19-14(18-20-21)17-15(27)16-13(23)12-8-7-11(26-12)9-5-3-4-6-10(9)22(24)25/h3-8H,2H2,1H3,(H2,16,17,19,23,27)