5-[(4-methylcyclohexyl)amino]-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde

Systemtic Name: 5-[(4-methylcyclohexyl)amino]-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde Openeye Name: 5-[(4-methylcyclohexyl)amino]-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde CAS Name: 5-[(4-methylcyclohexyl)amino]-1-(5-methylsulfonyl-2-pyridinyl)-3-(trifluoromethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 5-[(4-methylcyclohexyl)amino]-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde Traditional Name: 1-(5-mesyl-2-pyridyl)-5-[(4-methylcyclohexyl)amino]-3-(trifluoromethyl)pyrazole-4-carbaldehyde Formula: C18H21F3N4O3S MolecularWeight: 430.44455

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC2=C(C(=NN2C3=NC=C(C=C3)S(=O)(=O)C)C(F)(F)F)C=O

Isomeric SMILES

CC1CCC(CC1)NC2=C(C(=NN2C3=NC=C(C=C3)S(=O)(=O)C)C(F)(F)F)C=O

InChI

InChI=1S/C18H21F3N4O3S/c1-11-3-5-12(6-4-11)23-17-14(10-26)16(18(19,20)21)24-25(17)15-8-7-13(9-22-15)29(2,27)28/h7-12,23H,3-6H2,1-2H3