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

Systemtic Name: 1-[1-[6-[(3-chlorophenyl)amino]pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone Openeye Name: 1-[1-[6-(3-chloroanilino)pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone CAS Name: 1-[1-[6-(3-chloroanilino)-4-pyrimidinyl]-5-methyl-4-pyrazolyl]ethanone IUPAC Name: 1-[1-[6-(3-chloroanilino)pyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone Traditional Name: 1-[1-[6-(3-chloroanilino)pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone Formula: C16H14ClN5O MolecularWeight: 327.76826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN5O/c1-10-14(11(2)23)8-20-22(10)16-7-15(18-9-19-16)21-13-5-3-4-12(17)6-13/h3-9H,1-2H3,(H,18,19,21)