5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-[2-(2-pyridyl)ethyl]pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-[2-(2-pyridinyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-[2-(2-pyridyl)ethyl]pyrazole-3-carboxamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCCC3=CC=CC=N3)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCCC3=CC=CC=N3)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C25H23N5O3/c1-17-9-10-19(14-18(17)2)23-16-24(25(31)27-13-11-20-6-3-4-12-26-20)29(28-23)21-7-5-8-22(15-21)30(32)33/h3-10,12,14-16H,11,13H2,1-2H3,(H,27,31)