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

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

Click to see the large picture

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)12-7-6-11(26-12)9-4-3-5-10(8-9)22(24)25/h3-8H,2H2,1H3,(H2,16,17,19,23,27)