1-(3-methylphenyl)-3-[3-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)propyl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[3-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)propyl]urea Openeye Name: 1-(m-tolyl)-3-[3-[6-oxo-3-(4-pyridyl)pyridazin-1-yl]propyl]urea CAS Name: 1-(3-methylphenyl)-3-[3-(6-oxo-3-pyridin-4-yl-1-pyridazinyl)propyl]urea IUPAC Name: 1-(3-methylphenyl)-3-[3-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propyl]urea Traditional Name: 1-[3-[6-keto-3-(4-pyridyl)pyridazin-1-yl]propyl]-3-(m-tolyl)urea Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=NC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C20H21N5O2/c1-15-4-2-5-17(14-15)23-20(27)22-10-3-13-25-19(26)7-6-18(24-25)16-8-11-21-12-9-16/h2,4-9,11-12,14H,3,10,13H2,1H3,(H2,22,23,27)