N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-propanamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-propanamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-propanamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-3-phenylpropanamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenylpropanamide Traditional Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-propionamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CCCN3CCOCC3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CCCN3CCOCC3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2S/c1-19-17-22-23(18-20(19)2)31-25(26-22)28(12-6-11-27-13-15-30-16-14-27)24(29)10-9-21-7-4-3-5-8-21/h3-5,7-8,17-18H,6,9-16H2,1-2H3