N-[5-(1-cyanoethylcarbamoyl)-1-methyl-pyrazol-3-yl]-2-methyl-5-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrazole-3-carboxamide

Systemtic Name: N-[5-(1-cyanoethylcarbamoyl)-1-methyl-pyrazol-3-yl]-2-methyl-5-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrazole-3-carboxamide Openeye Name: N-[5-(1-cyanoethylcarbamoyl)-1-methyl-pyrazol-3-yl]-2-methyl-5-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrazole-3-carboxamide CAS Name: N-[5-[(1-cyanoethylamino)-oxomethyl]-1-methyl-3-pyrazolyl]-2-methyl-5-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-3-pyrazolecarboxamide IUPAC Name: N-[5-(1-cyanoethylcarbamoyl)-1-methylpyrazol-3-yl]-2-methyl-5-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrazole-3-carboxamide Traditional Name: N-[5-(1-cyanoethylcarbamoyl)-1-methyl-pyrazol-3-yl]-2-methyl-5-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrazole-3-carboxamide Formula: C19H20N10O5 MolecularWeight: 468.4261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)NC(=O)C1=CC(=NN1C)NC(=O)C2=CC(=NN2C)NC(=O)C3=CC(=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC(C#N)NC(=O)C1=CC(=NN1C)NC(=O)C2=CC(=NN2C)NC(=O)C3=CC(=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C19H20N10O5/c1-10(8-20)21-18(31)13-6-16(25-27(13)3)23-19(32)14-7-15(24-28(14)4)22-17(30)12-5-11(29(33)34)9-26(12)2/h5-7,9-10H,1-4H3,(H,21,31)(H,22,24,30)(H,23,25,32)