4-[2-[3-(3-acetamido-4-ethyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[3-(3-acetamido-4-ethyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[3-(3-acetamido-4-ethyl-phenyl)-6-oxo-pyridazin-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[3-(3-acetamido-4-ethylphenyl)-6-oxo-1-pyridazinyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[3-(3-acetamido-4-ethylphenyl)-6-oxopyridazin-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[3-(3-acetamido-4-ethyl-phenyl)-6-keto-pyridazin-1-yl]acetyl]amino]benzamide Formula: C23H23N5O4 MolecularWeight: 433.45982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)N)NC(=O)C

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)N)NC(=O)C

InChI

InChI=1S/C23H23N5O4/c1-3-15-4-5-17(12-20(15)25-14(2)29)19-10-11-22(31)28(27-19)13-21(30)26-18-8-6-16(7-9-18)23(24)32/h4-12H,3,13H2,1-2H3,(H2,24,32)(H,25,29)(H,26,30)