[2-(1H-indol-3-ylmethyl)-4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone

Systemtic Name: [2-(1H-indol-3-ylmethyl)-4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Openeye Name: [2-(1H-indol-3-ylmethyl)-4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone CAS Name: [2-(1H-indol-3-ylmethyl)-4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone IUPAC Name: [2-(1H-indol-3-ylmethyl)-4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Traditional Name: [2-(1H-indol-3-ylmethyl)-4-[(1-methylpyrazol-4-yl)methyl]piperazino]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Formula: C27H28F3N5O2 MolecularWeight: 511.53873

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCN(C(C2)CC3=CNC4=CC=CC=C43)C(=O)C5=CC(=CC(=C5)OC)C(F)(F)F

Isomeric SMILES

CN1C=C(C=N1)CN2CCN(C(C2)CC3=CNC4=CC=CC=C43)C(=O)C5=CC(=CC(=C5)OC)C(F)(F)F

InChI

InChI=1S/C27H28F3N5O2/c1-33-15-18(13-32-33)16-34-7-8-35(22(17-34)10-20-14-31-25-6-4-3-5-24(20)25)26(36)19-9-21(27(28,29)30)12-23(11-19)37-2/h3-6,9,11-15,22,31H,7-8,10,16-17H2,1-2H3