4-methoxy-2,3,6-trimethyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-methoxy-2,3,6-trimethyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Openeye Name: 4-methoxy-2,3,6-trimethyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide CAS Name: 4-methoxy-2,3,6-trimethyl-N-[3-(2-methyl-4-pyrimidinyl)phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-2,3,6-trimethyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Traditional Name: 4-methoxy-2,3,6-trimethyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)C)C)OC

InChI

InChI=1S/C21H23N3O3S/c1-13-11-20(27-5)14(2)15(3)21(13)28(25,26)24-18-8-6-7-17(12-18)19-9-10-22-16(4)23-19/h6-12,24H,1-5H3