N-[(E)-(4-bromophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(4-bromophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(4-bromophenyl)methyleneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(4-bromophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(4-bromophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-(4-bromobenzylidene)amino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide Formula: C19H17BrN4O3 MolecularWeight: 429.26728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C19H17BrN4O3/c1-26-17-8-5-13(9-18(17)27-2)15-10-16(23-22-15)19(25)24-21-11-12-3-6-14(20)7-4-12/h3-11H,1-2H3,(H,22,23)(H,24,25)/b21-11+