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

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-phenylsulfanyl-acetamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-2-(phenylthio)acetamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanylacetamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-(phenylthio)acetamide Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O2S2/c1-2-19-9-10-21-22(17-19)31-24(25-21)27(12-6-11-26-13-15-29-16-14-26)23(28)18-30-20-7-4-3-5-8-20/h3-5,7-10,17H,2,6,11-16,18H2,1H3