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

Systemtic Name: (E)-2-cyano-N-(6-ethoxy-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-(6-ethoxy-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-prop-2-enoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(6-ethoxy-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-(6-ethoxy-1,3-benzothiazol-2-yl)acrylamide Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=CC3=CC(=C(C=C3)OCC=C)OC)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)/C(=C/C3=CC(=C(C=C3)OCC=C)OC)/C#N

InChI

InChI=1S/C23H21N3O4S/c1-4-10-30-19-9-6-15(12-20(19)28-3)11-16(14-24)22(27)26-23-25-18-8-7-17(29-5-2)13-21(18)31-23/h4,6-9,11-13H,1,5,10H2,2-3H3,(H,25,26,27)/b16-11+