1-(4-methoxyphenyl)-3-[3-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)propyl]urea

Systemtic Name: 1-(4-methoxyphenyl)-3-[3-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)propyl]urea Openeye Name: 1-(4-methoxyphenyl)-3-[3-(6-oxo-3-phenyl-pyridazin-1-yl)propyl]urea CAS Name: 1-(4-methoxyphenyl)-3-[3-(6-oxo-3-phenyl-1-pyridazinyl)propyl]urea IUPAC Name: 1-(4-methoxyphenyl)-3-[3-(6-oxo-3-phenylpyridazin-1-yl)propyl]urea Traditional Name: 1-[3-(6-keto-3-phenyl-pyridazin-1-yl)propyl]-3-(4-methoxyphenyl)urea Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3/c1-28-18-10-8-17(9-11-18)23-21(27)22-14-5-15-25-20(26)13-12-19(24-25)16-6-3-2-4-7-16/h2-4,6-13H,5,14-15H2,1H3,(H2,22,23,27)