(E)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enamide Openeye Name: (E)-3-(4-allyloxy-3-methoxy-phenyl)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-prop-2-enoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-allyloxy-3-methoxy-phenyl)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)acrylamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)C(=CC3=CC(=C(C=C3)OCC=C)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)/C(=C/C3=CC(=C(C=C3)OCC=C)OC)/C#N

InChI

InChI=1S/C23H21N3O3S/c1-5-8-29-19-7-6-16(12-20(19)28-4)11-17(13-24)22(27)26-23-25-18-9-14(2)15(3)10-21(18)30-23/h5-7,9-12H,1,8H2,2-4H3,(H,25,26,27)/b17-11+