3-(4-methylphenyl)sulfonyl-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-methylphenyl)sulfonyl-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(6-phenoxy-1,3-benzothiazol-2-yl)-3-(p-tolylsulfonyl)propanamide CAS Name: 3-(4-methylphenyl)sulfonyl-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-methylphenyl)sulfonyl-N-(6-phenoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(6-phenoxy-1,3-benzothiazol-2-yl)-3-tosyl-propionamide Formula: C23H20N2O4S2 MolecularWeight: 452.5459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S2/c1-16-7-10-19(11-8-16)31(27,28)14-13-22(26)25-23-24-20-12-9-18(15-21(20)30-23)29-17-5-3-2-4-6-17/h2-12,15H,13-14H2,1H3,(H,24,25,26)