N-[4-(cyanomethyl)phenyl]-5-piperidin-4-yl-1-(4-propan-2-ylphenyl)pyrazole-4-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-5-piperidin-4-yl-1-(4-propan-2-ylphenyl)pyrazole-4-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-1-(4-isopropylphenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-5-(4-piperidinyl)-1-(4-propan-2-ylphenyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-5-piperidin-4-yl-1-(4-propan-2-ylphenyl)pyrazole-4-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-1-p-cumenyl-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C26H29N5O MolecularWeight: 427.54136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)CC#N)C4CCNCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)CC#N)C4CCNCC4

InChI

InChI=1S/C26H29N5O/c1-18(2)20-5-9-23(10-6-20)31-25(21-12-15-28-16-13-21)24(17-29-31)26(32)30-22-7-3-19(4-8-22)11-14-27/h3-10,17-18,21,28H,11-13,15-16H2,1-2H3,(H,30,32)