N-[2-[3,4-bis(fluoranyl)phenyl]-2-piperidin-1-yl-ethyl]-4-chloranyl-1-pyrimidin-2-yl-indole-3-carboxamide

Systemtic Name: N-[2-[3,4-bis(fluoranyl)phenyl]-2-piperidin-1-yl-ethyl]-4-chloranyl-1-pyrimidin-2-yl-indole-3-carboxamide Openeye Name: 4-chloro-N-[2-(3,4-difluorophenyl)-2-(1-piperidyl)ethyl]-1-pyrimidin-2-yl-indole-3-carboxamide CAS Name: 4-chloro-N-[2-(3,4-difluorophenyl)-2-(1-piperidinyl)ethyl]-1-(2-pyrimidinyl)-3-indolecarboxamide IUPAC Name: 4-chloro-N-[2-(3,4-difluorophenyl)-2-piperidin-1-ylethyl]-1-pyrimidin-2-ylindole-3-carboxamide Traditional Name: 4-chloro-N-[2-(3,4-difluorophenyl)-2-piperidino-ethyl]-1-(2-pyrimidyl)indole-3-carboxamide Formula: C26H24ClF2N5O MolecularWeight: 495.951466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)C2=CN(C3=C2C(=CC=C3)Cl)C4=NC=CC=N4)C5=CC(=C(C=C5)F)F

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)C2=CN(C3=C2C(=CC=C3)Cl)C4=NC=CC=N4)C5=CC(=C(C=C5)F)F

InChI

InChI=1S/C26H24ClF2N5O/c27-19-6-4-7-22-24(19)18(16-34(22)26-30-10-5-11-31-26)25(35)32-15-23(33-12-2-1-3-13-33)17-8-9-20(28)21(29)14-17/h4-11,14,16,23H,1-3,12-13,15H2,(H,32,35)