2-ethylsulfanyl-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide

Systemtic Name: 2-ethylsulfanyl-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide Openeye Name: 2-ethylsulfanyl-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)pyridine-4-carboxamide CAS Name: 2-(ethylthio)-N-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-4-pyridinecarboxamide IUPAC Name: 2-ethylsulfanyl-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide Traditional Name: 2-(ethylthio)-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)isonicotinamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

Isomeric SMILES

CCSC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

InChI

InChI=1S/C20H22N4O3S2/c1-3-28-16-12-13(6-7-21-16)19(25)23-20-22-17-15(26-2)5-4-14(18(17)29-20)24-8-10-27-11-9-24/h4-7,12H,3,8-11H2,1-2H3,(H,22,23,25)