5-ethyl-1-(4-methylphenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]pyrazole-4-carboxamide

Systemtic Name: 5-ethyl-1-(4-methylphenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]pyrazole-4-carboxamide Openeye Name: 5-ethyl-N-[2-(2-nitroanilino)ethyl]-1-(p-tolyl)pyrazole-4-carboxamide CAS Name: 5-ethyl-1-(4-methylphenyl)-N-[2-(2-nitroanilino)ethyl]-4-pyrazolecarboxamide IUPAC Name: 5-ethyl-1-(4-methylphenyl)-N-[2-(2-nitroanilino)ethyl]pyrazole-4-carboxamide Traditional Name: 5-ethyl-N-[2-(2-nitroanilino)ethyl]-1-(p-tolyl)pyrazole-4-carboxamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)C)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)C)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O3/c1-3-19-17(14-24-25(19)16-10-8-15(2)9-11-16)21(27)23-13-12-22-18-6-4-5-7-20(18)26(28)29/h4-11,14,22H,3,12-13H2,1-2H3,(H,23,27)