methyl 2-[[4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-[6-oxo-1-(p-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]amino]benzoate CAS Name: 2-[[[4-[1-(4-methylphenyl)-6-oxo-3-pyridazinyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-[1-(4-methylphenyl)-6-oxopyridazin-3-yl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 2-[[4-[6-keto-1-(p-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]amino]benzoic acid methyl ester Formula: C24H25N5O4 MolecularWeight: 447.4864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C24H25N5O4/c1-17-7-9-18(10-8-17)29-22(30)12-11-21(26-29)27-13-15-28(16-14-27)24(32)25-20-6-4-3-5-19(20)23(31)33-2/h3-12H,13-16H2,1-2H3,(H,25,32)