N-[1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[(E)-3-(1,3-diphenyl-4-pyrazolyl)-1-oxoprop-2-enyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[(E)-3-(1,3-diphenylpyrazol-4-yl)acryloyl]-4-piperidyl]-4-fluoro-benzamide Formula: C30H27FN4O2 MolecularWeight: 494.559383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)C(=O)C=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)C(=O)/C=C/C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H27FN4O2/c31-25-14-11-23(12-15-25)30(37)32-26-17-19-34(20-18-26)28(36)16-13-24-21-35(27-9-5-2-6-10-27)33-29(24)22-7-3-1-4-8-22/h1-16,21,26H,17-20H2,(H,32,37)/b16-13+