N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-propanamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-propanamide Openeye Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-propanamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-3-phenylpropanamide IUPAC Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenylpropanamide Traditional Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-propionamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CCCN3CCOCC3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CCCN3CCOCC3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c1-30-20-10-11-21(31-2)24-23(20)26-25(33-24)28(14-6-13-27-15-17-32-18-16-27)22(29)12-9-19-7-4-3-5-8-19/h3-5,7-8,10-11H,6,9,12-18H2,1-2H3