N-(phenylmethyl)-1-[(E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-[(E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-benzyl-1-[(E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]prop-2-enyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[(E)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[(E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acryloyl]isonipecotamide Formula: C30H29N5O2 MolecularWeight: 491.58356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)C=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)/C=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H29N5O2/c36-28(34-18-15-24(16-19-34)30(37)32-20-23-8-3-1-4-9-23)14-13-26-22-35(27-11-5-2-6-12-27)33-29(26)25-10-7-17-31-21-25/h1-14,17,21-22,24H,15-16,18-20H2,(H,32,37)/b14-13+