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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-piperonylamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22ClN3O4S/c23-16-3-4-17-20(13-16)31-22(24-17)26(7-1-6-25-8-10-28-11-9-25)21(27)15-2-5-18-19(12-15)30-14-29-18/h2-5,12-13H,1,6-11,14H2