N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholinopropyl)benzamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-(methylthio)-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-3-(methylthio)-N-(3-morpholinopropyl)benzamide 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)C4=CC(=CC=C4)SC

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3S2/c1-28-18-7-8-21-20(16-18)24-23(31-21)26(10-4-9-25-11-13-29-14-12-25)22(27)17-5-3-6-19(15-17)30-2/h3,5-8,15-16H,4,9-14H2,1-2H3