2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid 2-[4-[3-[2-(trifluoromethyl)-10-phenothiazinyl]propyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-(2-keto-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazino]ethyl ester Formula: C35H37F3N6O3S MolecularWeight: 678.76689

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1N2C3=CC=CC=C3NC2=O)C(=O)OCCN4CCN(CC4)CCCN5C6=CC=CC=C6SC7=C5C=C(C=C7)C(F)(F)F

Isomeric SMILES

C1CN(CC=C1N2C3=CC=CC=C3NC2=O)C(=O)OCCN4CCN(CC4)CCCN5C6=CC=CC=C6SC7=C5C=C(C=C7)C(F)(F)F

InChI

InChI=1S/C35H37F3N6O3S/c36-35(37,38)25-10-11-32-30(24-25)43(29-8-3-4-9-31(29)48-32)15-5-14-40-18-20-41(21-19-40)22-23-47-34(46)42-16-12-26(13-17-42)44-28-7-2-1-6-27(28)39-33(44)45/h1-4,6-12,24H,5,13-23H2,(H,39,45)