ethyl 5-azanyl-4-cyano-3-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(6-methyl-2-nitro-3-pyridinyl)oxymethyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(6-methyl-2-nitropyridin-3-yl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H14N4O5S MolecularWeight: 362.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=C(N=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=C(N=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O5S/c1-3-23-15(20)12-10(9(6-16)13(17)25-12)7-24-11-5-4-8(2)18-14(11)19(21)22/h4-5H,3,7,17H2,1-2H3