4-[4-(cyclohexylmethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]benzenesulfonamide

Systemtic Name: 4-[4-(cyclohexylmethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]benzenesulfonamide Openeye Name: 4-[4-(cyclohexylmethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]benzenesulfonamide CAS Name: 4-[4-(cyclohexylmethylamino)-6-(trifluoromethyl)-2-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-[4-(cyclohexylmethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]benzenesulfonamide Traditional Name: 4-[4-(cyclohexylmethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]benzenesulfonamide Formula: C18H21F3N4O2S MolecularWeight: 414.44515

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC2=NC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CCC(CC1)CNC2=NC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H21F3N4O2S/c19-18(20,21)15-10-16(23-11-12-4-2-1-3-5-12)25-17(24-15)13-6-8-14(9-7-13)28(22,26)27/h6-10,12H,1-5,11H2,(H2,22,26,27)(H,23,24,25)