3-(4-methylphenyl)-N-(6-morpholin-4-ylpyridin-3-yl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-(6-morpholin-4-ylpyridin-3-yl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(6-morpholino-3-pyridyl)-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: 3-(4-methylphenyl)-N-[6-(4-morpholinyl)-3-pyridinyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(4-methylphenyl)-N-(6-morpholin-4-ylpyridin-3-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(6-morpholino-3-pyridyl)-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)NC3=CN=C(C=C3)N4CCOCC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CN=C(C=C3)N4CCOCC4)CC5=CC=CC=C5

InChI

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