4-(4-bromanylpyrazol-1-yl)-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]benzamide Formula: C21H19BrF3N5O MolecularWeight: 494.30767

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H19BrF3N5O/c22-16-12-27-30(13-16)18-4-1-14(2-5-18)20(31)28-17-7-9-29(10-8-17)19-6-3-15(11-26-19)21(23,24)25/h1-6,11-13,17H,7-10H2,(H,28,31)