N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(2-pyrimidylamino)benzamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C22H20N6O/c1-27(15-17-14-25-28(16-17)20-9-3-2-4-10-20)21(29)18-7-5-8-19(13-18)26-22-23-11-6-12-24-22/h2-14,16H,15H2,1H3,(H,23,24,26)