2-[1,3-benzothiazol-2-yl-(3,5-dimethylphenyl)amino]-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-yl-(3,5-dimethylphenyl)amino]-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-[N-(1,3-benzothiazol-2-yl)-3,5-dimethyl-anilino]-N-(3-morpholinosulfonylphenyl)acetamide CAS Name: 2-[N-(1,3-benzothiazol-2-yl)-3,5-dimethylanilino]-N-[3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[N-(1,3-benzothiazol-2-yl)-3,5-dimethylanilino]-N-(3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[N-(1,3-benzothiazol-2-yl)-3,5-dimethyl-anilino]-N-(3-morpholinosulfonylphenyl)acetamide Formula: C27H28N4O4S2 MolecularWeight: 536.66562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C27H28N4O4S2/c1-19-14-20(2)16-22(15-19)31(27-29-24-8-3-4-9-25(24)36-27)18-26(32)28-21-6-5-7-23(17-21)37(33,34)30-10-12-35-13-11-30/h3-9,14-17H,10-13,18H2,1-2H3,(H,28,32)