(E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenyl-acrylamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)C=CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)/C=C/C4=CC=CC=C4)C

InChI

InChI=1S/C25H29N3O2S/c1-19-9-11-22-24(20(19)2)26-25(31-22)28(14-6-13-27-15-17-30-18-16-27)23(29)12-10-21-7-4-3-5-8-21/h3-5,7-12H,6,13-18H2,1-2H3/b12-10+