N-[6-chloranyl-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[6-chloranyl-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxido-4-pyridin-1-iumyl)-4-pyrimidinyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-4-(methylthio)benzenesulfonamide Formula: C23H19ClN4O5S2 MolecularWeight: 531.00376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(N=C(N=C2Cl)C3=CC=[N+](C=C3)[O-])NS(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC=CC=C1OC2=C(N=C(N=C2Cl)C3=CC=[N+](C=C3)[O-])NS(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C23H19ClN4O5S2/c1-32-18-5-3-4-6-19(18)33-20-21(24)25-22(15-11-13-28(29)14-12-15)26-23(20)27-35(30,31)17-9-7-16(34-2)8-10-17/h3-14H,1-2H3,(H,25,26,27)