N-[3,5-bis(trifluoromethyl)phenyl]-3-(4-butylpiperazin-1-yl)azetidine-1-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(4-butylpiperazin-1-yl)azetidine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(4-butylpiperazin-1-yl)azetidine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(4-butyl-1-piperazinyl)-1-azetidinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(4-butylpiperazin-1-yl)azetidine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(4-butylpiperazino)azetidine-1-carboxamide Formula: C20H26F6N4O MolecularWeight: 452.437059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2CN(C2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCCN1CCN(CC1)C2CN(C2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C20H26F6N4O/c1-2-3-4-28-5-7-29(8-6-28)17-12-30(13-17)18(31)27-16-10-14(19(21,22)23)9-15(11-16)20(24,25)26/h9-11,17H,2-8,12-13H2,1H3,(H,27,31)