1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: 1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: 1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: 1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(4-bromophenyl)-N-homoveratryl-6-keto-4,5-dihydropyridazine-3-carboxamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=NN(C(=O)CC2)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=NN(C(=O)CC2)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C21H22BrN3O4/c1-28-18-9-3-14(13-19(18)29-2)11-12-23-21(27)17-8-10-20(26)25(24-17)16-6-4-15(22)5-7-16/h3-7,9,13H,8,10-12H2,1-2H3,(H,23,27)