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

Systemtic Name: 1-(4-bromophenyl)-5-methyl-N-[2-[(4-nitrophenyl)amino]ethyl]pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-5-methyl-N-[2-(4-nitroanilino)ethyl]pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-5-methyl-N-[2-(4-nitroanilino)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-5-methyl-N-[2-(4-nitroanilino)ethyl]pyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-5-methyl-N-[2-(4-nitroanilino)ethyl]pyrazole-4-carboxamide Formula: C19H18BrN5O3 MolecularWeight: 444.28192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18BrN5O3/c1-13-18(12-23-24(13)16-6-2-14(20)3-7-16)19(26)22-11-10-21-15-4-8-17(9-5-15)25(27)28/h2-9,12,21H,10-11H2,1H3,(H,22,26)