N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-phenylsulfanyl-acetamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-2-(phenylthio)acetamide IUPAC Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanylacetamide Traditional Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-(phenylthio)acetamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3S2/c1-28-18-8-9-21-20(16-18)24-23(31-21)26(11-5-10-25-12-14-29-15-13-25)22(27)17-30-19-6-3-2-4-7-19/h2-4,6-9,16H,5,10-15,17H2,1H3