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

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-propanamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-propanamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-3-phenylpropanamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenylpropanamide Traditional Name: N-(4,7-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=C2C(=C(C=C1)C)SC(=N2)N(CCCN3CCOCC3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N(CCCN3CCOCC3)C(=O)CCC4=CC=CC=C4

InChI

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