N-methyl-3-[[(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]methyl]benzenesulfonamide

Systemtic Name: N-methyl-3-[[(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]methyl]benzenesulfonamide Openeye Name: N-methyl-3-[[(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]methyl]benzenesulfonamide CAS Name: N-methyl-3-[[(2-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]methyl]benzenesulfonamide IUPAC Name: N-methyl-3-[[(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]benzenesulfonamide Traditional Name: N-methyl-3-[[(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]methyl]benzenesulfonamide Formula: C21H20N4O2S2 MolecularWeight: 424.5391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)NCC4=CC(=CC=C4)S(=O)(=O)NC

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)NCC4=CC(=CC=C4)S(=O)(=O)NC

InChI

InChI=1S/C21H20N4O2S2/c1-14-24-20(23-12-15-7-6-10-17(11-15)29(26,27)22-2)19-18(13-28-21(19)25-14)16-8-4-3-5-9-16/h3-11,13,22H,12H2,1-2H3,(H,23,24,25)