N-tert-butyl-3-[[5-methyl-2-[[4-piperazin-1-yl-3-(trifluoromethyl)phenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-[[5-methyl-2-[[4-piperazin-1-yl-3-(trifluoromethyl)phenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N-tert-butyl-3-[[5-methyl-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N-tert-butyl-3-[[5-methyl-2-[4-(1-piperazinyl)-3-(trifluoromethyl)anilino]-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N-tert-butyl-3-[[5-methyl-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: N-tert-butyl-3-[[5-methyl-2-[4-piperazino-3-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide Formula: C26H32F3N7O2S MolecularWeight: 563.63819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)NC3=CC(=C(C=C3)N4CCNCC4)C(F)(F)F

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)NC3=CC(=C(C=C3)N4CCNCC4)C(F)(F)F

InChI

InChI=1S/C26H32F3N7O2S/c1-17-16-31-24(33-19-8-9-22(21(15-19)26(27,28)29)36-12-10-30-11-13-36)34-23(17)32-18-6-5-7-20(14-18)39(37,38)35-25(2,3)4/h5-9,14-16,30,35H,10-13H2,1-4H3,(H2,31,32,33,34)