4-[2-[[3,5-bis(trifluoromethyl)phenyl]carbonylamino]-3-methyl-pentanoyl]-N-butyl-2-methyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[[3,5-bis(trifluoromethyl)phenyl]carbonylamino]-3-methyl-pentanoyl]-N-butyl-2-methyl-piperazine-1-carboxamide Openeye Name: 4-[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-pentanoyl]-N-butyl-2-methyl-piperazine-1-carboxamide CAS Name: 4-[2-[[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]-N-butyl-2-methyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methylpentanoyl]-N-butyl-2-methylpiperazine-1-carboxamide Traditional Name: 4-[2-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-pentanoyl]-N-butyl-2-methyl-piperazine-1-carboxamide Formula: C25H34F6N4O3 MolecularWeight: 552.552879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H34F6N4O3/c1-5-7-8-32-23(38)35-10-9-34(14-16(35)4)22(37)20(15(3)6-2)33-21(36)17-11-18(24(26,27)28)13-19(12-17)25(29,30)31/h11-13,15-16,20H,5-10,14H2,1-4H3,(H,32,38)(H,33,36)