2-cyano-3-(3,4-dimethoxyphenyl)-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]prop-2-enamide

Systemtic Name: 2-cyano-3-(3,4-dimethoxyphenyl)-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]prop-2-enamide Openeye Name: N-(5-benzylthiazol-2-yl)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enamide CAS Name: 2-cyano-3-(3,4-dimethoxyphenyl)-N-[5-(phenylmethyl)-2-thiazolyl]-2-propenamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enamide Traditional Name: N-(5-benzylthiazol-2-yl)-2-cyano-3-(3,4-dimethoxyphenyl)acrylamide Formula: C22H19N3O3S MolecularWeight: 405.46956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H19N3O3S/c1-27-19-9-8-16(12-20(19)28-2)10-17(13-23)21(26)25-22-24-14-18(29-22)11-15-6-4-3-5-7-15/h3-10,12,14H,11H2,1-2H3,(H,24,25,26)