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

Systemtic Name: methyl 2-[2-(3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: methyl 2-[2-(3-amino-4-cyclohexyl-2-hydroxy-butanoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[(3-amino-4-cyclohexyl-2-hydroxy-1-oxobutyl)hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(3-amino-4-cyclohexyl-2-hydroxybutanoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[N'-(3-amino-4-cyclohexyl-2-hydroxy-butanoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid methyl ester Formula: C17H24F3N5O4 MolecularWeight: 419.39877

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C(C(CC2CCCCC2)N)O

Isomeric SMILES

COC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C(C(CC2CCCCC2)N)O

InChI

InChI=1S/C17H24F3N5O4/c1-29-15(28)10-8-22-16(23-13(10)17(18,19)20)25-24-14(27)12(26)11(21)7-9-5-3-2-4-6-9/h8-9,11-12,26H,2-7,21H2,1H3,(H,24,27)(H,22,23,25)