3-(4-bromophenyl)-N-[(E)-1-naphthalen-2-ylethylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-[(E)-1-naphthalen-2-ylethylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[(E)-1-(2-naphthyl)ethylideneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[(E)-1-(2-naphthalenyl)ethylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-[(E)-1-naphthalen-2-ylethylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[(E)-1-(2-naphthyl)ethylideneamino]-1H-pyrazole-5-carboxamide Formula: C22H17BrN4O MolecularWeight: 433.30058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Br)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Br)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H17BrN4O/c1-14(17-7-6-15-4-2-3-5-18(15)12-17)24-27-22(28)21-13-20(25-26-21)16-8-10-19(23)11-9-16/h2-13H,1H3,(H,25,26)(H,27,28)/b24-14+