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

Systemtic Name: methyl 4,5-dimethyl-2-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzoyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[[2-[(5-methyl-3-nitro-1-pyrazolyl)methyl]phenyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzoyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzoyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H20N4O5S MolecularWeight: 428.4616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=C(C(=C(S3)C)C)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=C(C(=C(S3)C)C)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5S/c1-11-9-16(24(27)28)22-23(11)10-14-7-5-6-8-15(14)18(25)21-19-17(20(26)29-4)12(2)13(3)30-19/h5-9H,10H2,1-4H3,(H,21,25)