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

Systemtic Name: (E)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-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-phenylmethoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-methoxy-phenyl)-2-cyano-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)acrylamide Formula: C27H23N3O3S MolecularWeight: 469.55482

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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)OCC4=CC=CC=C4)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)/C(=C/C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)/C#N

InChI

InChI=1S/C27H23N3O3S/c1-17-11-22-25(12-18(17)2)34-27(29-22)30-26(31)21(15-28)13-20-9-10-23(24(14-20)32-3)33-16-19-7-5-4-6-8-19/h4-14H,16H2,1-3H3,(H,29,30,31)/b21-13+