ethyl 5-ethanoyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[[1-[(2-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H20N4O7S MolecularWeight: 472.4711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O7S/c1-4-31-21(28)17-12(2)18(13(3)26)33-20(17)22-19(27)14-9-10-24(23-14)11-32-16-8-6-5-7-15(16)25(29)30/h5-10H,4,11H2,1-3H3,(H,22,27)