N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(phenylsulfonyl)ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(phenylsulfonyl)ethanamide Openeye Name: 2-(benzenesulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)acetamide CAS Name: 2-(benzenesulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-(benzenesulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-besyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)acetamide Formula: C24H29N3O5S2 MolecularWeight: 503.63416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H29N3O5S2/c1-2-32-19-9-10-21-22(17-19)33-24(25-21)27(12-6-11-26-13-15-31-16-14-26)23(28)18-34(29,30)20-7-4-3-5-8-20/h3-5,7-10,17H,2,6,11-16,18H2,1H3