O2-ethyl O4-propan-2-yl 3-methyl-5-[2-(3-nitropyrazol-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-propan-2-yl 3-methyl-5-[2-(3-nitropyrazol-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-isopropyl 3-methyl-5-[[2-(3-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(3-nitro-1-pyrazolyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propan-2-yl ester IUPAC Name: 2-O-ethyl 4-O-propan-2-yl 3-methyl-5-[[2-(3-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(3-nitropyrazol-1-yl)acetyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-isopropyl ester Formula: C17H20N4O7S MolecularWeight: 424.4283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C=CC(=N2)[N+](=O)[O-])C(=O)OC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C=CC(=N2)[N+](=O)[O-])C(=O)OC(C)C)C

InChI

InChI=1S/C17H20N4O7S/c1-5-27-17(24)14-10(4)13(16(23)28-9(2)3)15(29-14)18-12(22)8-20-7-6-11(19-20)21(25)26/h6-7,9H,5,8H2,1-4H3,(H,18,22)