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

Systemtic Name: N-[5-methyl-2-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitro-benzamide Openeye Name: N-[5-methyl-2-[4-(3-pyridylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitro-benzamide CAS Name: N-[5-methyl-2-[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[5-methyl-2-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]pyrazol-3-yl]-3-nitrobenzamide Traditional Name: N-[5-methyl-2-[4-(3-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=CN=CC=C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

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