N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-2-phenylsulfanyl-acetamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-2-(phenylthio)acetamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-phenylsulfanylacetamide Traditional Name: N-(4,7-dimethyl-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:

CC1=C2C(=C(C=C1)C)SC(=N2)N(CCCN3CCOCC3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N(CCCN3CCOCC3)C(=O)CSC4=CC=CC=C4

InChI

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