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

Systemtic Name: N-phenyl-1-[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-phenyl-1-[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)prop-2-enyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: N-phenyl-1-[(E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-phenyl-1-[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acryloyl]isonipecotamide Formula: C28H26N4O2S MolecularWeight: 482.59664

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)/C=C/C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N4O2S/c33-26(31-17-15-21(16-18-31)28(34)29-23-8-3-1-4-9-23)14-13-22-20-32(24-10-5-2-6-11-24)30-27(22)25-12-7-19-35-25/h1-14,19-21H,15-18H2,(H,29,34)/b14-13+