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

Systemtic Name: 2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H23N3O5S2/c1-14-4-3-5-17-20(14)23-21(30-17)22-19(25)13-15-6-7-16(28-2)18(12-15)31(26,27)24-8-10-29-11-9-24/h3-7,12H,8-11,13H2,1-2H3,(H,22,23,25)