3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-N-[1-(phenylmethyl)piperidin-4-yl]prop-2-enamide

Systemtic Name: 3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-N-[1-(phenylmethyl)piperidin-4-yl]prop-2-enamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-enamide CAS Name: 3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-N-[1-(phenylmethyl)-4-piperidinyl]-2-propenamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]acrylamide Formula: C31H32N4O MolecularWeight: 476.61198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)NC3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)NC3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H32N4O/c1-24-12-14-26(15-13-24)31-27(23-35(33-31)29-10-6-3-7-11-29)16-17-30(36)32-28-18-20-34(21-19-28)22-25-8-4-2-5-9-25/h2-17,23,28H,18-22H2,1H3,(H,32,36)