5-azanyl-4-cyano-3-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiophene-2-carboxamide

Systemtic Name: 5-azanyl-4-cyano-3-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiophene-2-carboxamide Openeye Name: 5-amino-4-cyano-3-methyl-N-[(E)-(5-nitro-2-furyl)methyleneamino]thiophene-2-carboxamide CAS Name: 5-amino-4-cyano-3-methyl-N-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-thiophenecarboxamide IUPAC Name: 5-amino-4-cyano-3-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiophene-2-carboxamide Traditional Name: 5-amino-4-cyano-3-methyl-N-[(E)-(5-nitro-2-furyl)methyleneamino]thiophene-2-carboxamide Formula: C12H9N5O4S MolecularWeight: 319.29596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)N)C(=O)NN=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=C1C#N)N)C(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O4S/c1-6-8(4-13)11(14)22-10(6)12(18)16-15-5-7-2-3-9(21-7)17(19)20/h2-3,5H,14H2,1H3,(H,16,18)/b15-5+