1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]pyrazole-3-carboxamide Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C=C1)CC2=CC=C(C=C2)Br)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1)CC2=CC=C(C=C2)Br)/C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H21BrN4O3/c1-14(18-9-8-17(28-2)12-20(18)29-3)23-24-21(27)19-10-11-26(25-19)13-15-4-6-16(22)7-5-15/h4-12H,13H2,1-3H3,(H,24,27)/b23-14+