3,4,5-triethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 3,4,5-triethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 3,4,5-triethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide CAS Name: 3,4,5-triethoxy-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 3,4,5-triethoxy-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-(2-morpholinoethyl)benzamide Formula: C27H35N3O5S2 MolecularWeight: 545.7139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)SC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)SC

InChI

InChI=1S/C27H35N3O5S2/c1-5-33-22-16-19(17-23(34-6-2)25(22)35-7-3)26(31)30(11-10-29-12-14-32-15-13-29)27-28-21-9-8-20(36-4)18-24(21)37-27/h8-9,16-18H,5-7,10-15H2,1-4H3