N-[2-(3-chlorophenyl)ethyl]-4-methoxy-7-morpholin-4-yl-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-4-methoxy-7-morpholin-4-yl-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-4-methoxy-7-morpholino-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-4-methoxy-7-(4-morpholinyl)-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-4-methoxy-7-morpholin-4-yl-1,3-benzothiazole-2-carboxamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-4-methoxy-7-morpholino-1,3-benzothiazole-2-carboxamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)N3CCOCC3)SC(=N2)C(=O)NCCC4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)N3CCOCC3)SC(=N2)C(=O)NCCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3O3S/c1-27-17-6-5-16(25-9-11-28-12-10-25)19-18(17)24-21(29-19)20(26)23-8-7-14-3-2-4-15(22)13-14/h2-6,13H,7-12H2,1H3,(H,23,26)