3-(4-methylphenyl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[(6-morpholino-3-pyridyl)methyl]-1-phenyl-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: 3-(4-methylphenyl)-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-methylphenyl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[(6-morpholino-3-pyridyl)methyl]-1-phenyl-3-(p-tolyl)pyrazole-4-carboxamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC3=CN=C(C=C3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC3=CN=C(C=C3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O2/c1-20-7-10-22(11-8-20)26-24(19-32(30-26)23-5-3-2-4-6-23)27(33)29-18-21-9-12-25(28-17-21)31-13-15-34-16-14-31/h2-12,17,19H,13-16,18H2,1H3,(H,29,33)