1-[5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxidanylidene-pyridazin-3-yl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxidanylidene-pyridazin-3-yl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxo-pyridazin-3-yl]-3-(4-methoxyphenyl)urea CAS Name: 1-[5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxo-3-pyridazinyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxopyridazin-3-yl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[5-cyano-6-keto-1-(4-methoxyphenyl)-4-methyl-pyridazin-3-yl]-3-(4-methoxyphenyl)urea Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1NC(=O)NC2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1NC(=O)NC2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C21H19N5O4/c1-13-18(12-22)20(27)26(15-6-10-17(30-3)11-7-15)25-19(13)24-21(28)23-14-4-8-16(29-2)9-5-14/h4-11H,1-3H3,(H2,23,24,25,28)