2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C21H23N3O5S3 MolecularWeight: 493.61942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SC)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SC)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H23N3O5S3/c1-28-17-6-3-14(11-19(17)32(26,27)24-7-9-29-10-8-24)12-20(25)22-15-4-5-16-18(13-15)31-21(23-16)30-2/h3-6,11,13H,7-10,12H2,1-2H3,(H,22,25)