N-[5-methyl-2-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitro-benzamide

Systemtic Name: N-[5-methyl-2-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitro-benzamide Openeye Name: N-[5-methyl-2-[4-(2-pyridylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitro-benzamide CAS Name: N-[5-methyl-2-[4-[oxo-(2-pyridinylmethylamino)methyl]phenyl]-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[5-methyl-2-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitrobenzamide Traditional Name: N-[5-methyl-2-[4-(2-pyridylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitro-benzamide Formula: C24H20N6O4 MolecularWeight: 456.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C24H20N6O4/c1-16-13-22(27-24(32)18-5-4-7-21(14-18)30(33)34)29(28-16)20-10-8-17(9-11-20)23(31)26-15-19-6-2-3-12-25-19/h2-14H,15H2,1H3,(H,26,31)(H,27,32)