N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-piperonylamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H25N3O5S/c1-28-17-4-5-18-21(14-17)32-23(24-18)26(8-2-7-25-9-11-29-12-10-25)22(27)16-3-6-19-20(13-16)31-15-30-19/h3-6,13-14H,2,7-12,15H2,1H3