1-[1-[6-[(3-chlorophenyl)amino]-2-methyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone

Systemtic Name: 1-[1-[6-[(3-chlorophenyl)amino]-2-methyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone Openeye Name: 1-[1-[6-(3-chloroanilino)-2-methyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone CAS Name: 1-[1-[6-(3-chloroanilino)-2-methyl-4-pyrimidinyl]-5-methyl-4-pyrazolyl]ethanone IUPAC Name: 1-[1-[6-(3-chloroanilino)-2-methylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone Traditional Name: 1-[1-[6-(3-chloroanilino)-2-methyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone Formula: C17H16ClN5O MolecularWeight: 341.79484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC(=NC(=N2)C)NC3=CC(=CC=C3)Cl)C(=O)C

Isomeric SMILES

CC1=C(C=NN1C2=CC(=NC(=N2)C)NC3=CC(=CC=C3)Cl)C(=O)C

InChI

InChI=1S/C17H16ClN5O/c1-10-15(11(2)24)9-19-23(10)17-8-16(20-12(3)21-17)22-14-6-4-5-13(18)7-14/h4-9H,1-3H3,(H,20,21,22)