4-[4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzamide

Systemtic Name: 4-[4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzamide Openeye Name: 4-[4-[3-(4-bromophenyl)-6-oxo-pyridazin-1-yl]butanoylamino]benzamide CAS Name: 4-[[4-[3-(4-bromophenyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]amino]benzamide IUPAC Name: 4-[4-[3-(4-bromophenyl)-6-oxopyridazin-1-yl]butanoylamino]benzamide Traditional Name: 4-[4-[3-(4-bromophenyl)-6-keto-pyridazin-1-yl]butanoylamino]benzamide Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=C(C=C3)C(=O)N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=C(C=C3)C(=O)N)Br

InChI

InChI=1S/C21H19BrN4O3/c22-16-7-3-14(4-8-16)18-11-12-20(28)26(25-18)13-1-2-19(27)24-17-9-5-15(6-10-17)21(23)29/h3-12H,1-2,13H2,(H2,23,29)(H,24,27)