N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(2-morpholinoethyl)benzamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 3-mesyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide Formula: C22H25N3O5S2 MolecularWeight: 475.581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C22H25N3O5S2/c1-29-17-6-7-20-19(15-17)23-22(31-20)25(9-8-24-10-12-30-13-11-24)21(26)16-4-3-5-18(14-16)32(2,27)28/h3-7,14-15H,8-13H2,1-2H3