N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-phenylsulfanyl-acetamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-2-(phenylthio)acetamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanylacetamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-(phenylthio)acetamide Formula: C22H24ClN3O2S2 MolecularWeight: 462.02786

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C22H24ClN3O2S2/c23-17-7-8-19-20(15-17)30-22(24-19)26(10-4-9-25-11-13-28-14-12-25)21(27)16-29-18-5-2-1-3-6-18/h1-3,5-8,15H,4,9-14,16H2