1-(4-chlorophenyl)-3-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]urea

Systemtic Name: 1-(4-chlorophenyl)-3-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]urea Openeye Name: 1-(4-chlorophenyl)-3-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]urea CAS Name: 1-(4-chlorophenyl)-3-[4-cyano-2-(4,6-dimethyl-2-pyrimidinyl)-5-methyl-3-pyrazolyl]urea IUPAC Name: 1-(4-chlorophenyl)-3-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]urea Traditional Name: 1-(4-chlorophenyl)-3-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]urea Formula: C18H16ClN7O MolecularWeight: 381.81894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=C(C(=N2)C)C#N)NC(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=C(C(=N2)C)C#N)NC(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H16ClN7O/c1-10-8-11(2)22-17(21-10)26-16(15(9-20)12(3)25-26)24-18(27)23-14-6-4-13(19)5-7-14/h4-8H,1-3H3,(H2,23,24,27)