2-[2-(3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-[2-(3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid Openeye Name: 2-[2-(3-amino-4-cyclohexyl-2-hydroxy-butanoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid CAS Name: 2-[(3-amino-4-cyclohexyl-2-hydroxy-1-oxobutyl)hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid IUPAC Name: 2-[2-(3-amino-4-cyclohexyl-2-hydroxybutanoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid Traditional Name: 2-[N'-(3-amino-4-cyclohexyl-2-hydroxy-butanoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid Formula: C16H22F3N5O4 MolecularWeight: 405.37219

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(C(=O)NNC2=NC=C(C(=N2)C(F)(F)F)C(=O)O)O)N

Isomeric SMILES

C1CCC(CC1)CC(C(C(=O)NNC2=NC=C(C(=N2)C(F)(F)F)C(=O)O)O)N

InChI

InChI=1S/C16H22F3N5O4/c17-16(18,19)12-9(14(27)28)7-21-15(22-12)24-23-13(26)11(25)10(20)6-8-4-2-1-3-5-8/h7-8,10-11,25H,1-6,20H2,(H,23,26)(H,27,28)(H,21,22,24)