methyl 2-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-methyl-1-oxopropyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-methylpropanoyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H20N4O5S MolecularWeight: 380.4188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C(C)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C(C)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C(=O)OC

InChI

InChI=1S/C16H20N4O5S/c1-8(7-19-11(4)13(20(23)24)10(3)18-19)14(21)17-15-12(16(22)25-5)6-9(2)26-15/h6,8H,7H2,1-5H3,(H,17,21)