(E)-2-cyano-N-(3-methylphenyl)-3-[4-(1,3-thiazol-4-ylmethoxy)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-methylphenyl)-3-[4-(1,3-thiazol-4-ylmethoxy)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(m-tolyl)-3-[4-(thiazol-4-ylmethoxy)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3-methylphenyl)-3-[4-(4-thiazolylmethoxy)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-methylphenyl)-3-[4-(1,3-thiazol-4-ylmethoxy)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(m-tolyl)-3-[4-(thiazol-4-ylmethoxy)phenyl]acrylamide Formula: C21H17N3O2S MolecularWeight: 375.44358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=CC2=CC=C(C=C2)OCC3=CSC=N3)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)/C(=C/C2=CC=C(C=C2)OCC3=CSC=N3)/C#N

InChI

InChI=1S/C21H17N3O2S/c1-15-3-2-4-18(9-15)24-21(25)17(11-22)10-16-5-7-20(8-6-16)26-12-19-13-27-14-23-19/h2-10,13-14H,12H2,1H3,(H,24,25)/b17-10+