N-butyl-1-piperidin-1-yl-N-[2,2,2-tris(fluoranyl)ethyl]-9H-thioxanthene-9-carboxamide

Systemtic Name: N-butyl-1-piperidin-1-yl-N-[2,2,2-tris(fluoranyl)ethyl]-9H-thioxanthene-9-carboxamide Openeye Name: N-butyl-1-(1-piperidyl)-N-(2,2,2-trifluoroethyl)-9H-thioxanthene-9-carboxamide CAS Name: N-butyl-1-(1-piperidinyl)-N-(2,2,2-trifluoroethyl)-9H-thioxanthene-9-carboxamide IUPAC Name: N-butyl-1-piperidin-1-yl-N-(2,2,2-trifluoroethyl)-9H-thioxanthene-9-carboxamide Traditional Name: N-butyl-1-piperidino-N-(2,2,2-trifluoroethyl)-9H-thioxanthene-9-carboxamide Formula: C25H29F3N2OS MolecularWeight: 462.57077

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(F)(F)F)C(=O)C1C2=CC=CC=C2SC3=CC=CC(=C13)N4CCCCC4

Isomeric SMILES

CCCCN(CC(F)(F)F)C(=O)C1C2=CC=CC=C2SC3=CC=CC(=C13)N4CCCCC4

InChI

InChI=1S/C25H29F3N2OS/c1-2-3-14-30(17-25(26,27)28)24(31)22-18-10-5-6-12-20(18)32-21-13-9-11-19(23(21)22)29-15-7-4-8-16-29/h5-6,9-13,22H,2-4,7-8,14-17H2,1H3