ethyl 2-[[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]furan-2-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-furoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H22N4O6S MolecularWeight: 446.47688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N4O6S/c1-6-29-20(26)16-10(2)13(5)31-19(16)21-18(25)15-8-7-14(30-15)9-23-12(4)17(24(27)28)11(3)22-23/h7-8H,6,9H2,1-5H3,(H,21,25)