3-[6-[4-(5-nitropyridin-2-yl)piperazin-1-yl]-5-phenyl-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 3-[6-[4-(5-nitropyridin-2-yl)piperazin-1-yl]-5-phenyl-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 3-[6-[4-(5-nitro-2-pyridyl)piperazin-1-yl]-5-phenyl-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide CAS Name: 3-[6-[4-(5-nitro-2-pyridinyl)-1-piperazinyl]-5-phenyl-2-(trifluoromethyl)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 3-[6-[4-(5-nitropyridin-2-yl)piperazin-1-yl]-5-phenyl-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 3-[6-[4-(5-nitro-2-pyridyl)piperazino]-5-phenyl-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide Formula: C26H22F3N7O4S MolecularWeight: 585.55759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)[N+](=O)[O-])C3=NC(=NC(=C3C4=CC=CC=C4)C5=CC(=CC=C5)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)[N+](=O)[O-])C3=NC(=NC(=C3C4=CC=CC=C4)C5=CC(=CC=C5)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C26H22F3N7O4S/c27-26(28,29)25-32-23(18-7-4-8-20(15-18)41(30,39)40)22(17-5-2-1-3-6-17)24(33-25)35-13-11-34(12-14-35)21-10-9-19(16-31-21)36(37)38/h1-10,15-16H,11-14H2,(H2,30,39,40)