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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=CC=C(C=C2)OCC3=CSC=N3)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C/C2=CC=C(C=C2)OCC3=CSC=N3)/C#N

InChI

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