(E)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-2-cyano-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-cyano-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-2-cyano-3-p-cumenyl-acrylamide Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C(=CC2=CC=C(C=C2)C(C)C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)/C(=C/C2=CC=C(C=C2)C(C)C)/C#N

InChI

InChI=1S/C22H22BrN3O2/c1-14(2)17-6-4-16(5-7-17)11-18(12-24)22(28)25-13-21(27)26-20-9-8-19(23)10-15(20)3/h4-11,14H,13H2,1-3H3,(H,25,28)(H,26,27)/b18-11+