2-[4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzamide

Systemtic Name: 2-[4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzamide Openeye Name: 2-[4-[3-(4-bromophenyl)-6-oxo-pyridazin-1-yl]butanoylamino]benzamide CAS Name: 2-[[4-[3-(4-bromophenyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]amino]benzamide IUPAC Name: 2-[4-[3-(4-bromophenyl)-6-oxopyridazin-1-yl]butanoylamino]benzamide Traditional Name: 2-[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=C(C(=C1)C(=O)N)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrN4O3/c22-15-9-7-14(8-10-15)17-11-12-20(28)26(25-17)13-3-6-19(27)24-18-5-2-1-4-16(18)21(23)29/h1-2,4-5,7-12H,3,6,13H2,(H2,23,29)(H,24,27)