(E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethylphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(2-cyanoethyl)-3-indolyl]-N-(3,4-dimethylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethylphenyl)acrylamide Formula: C23H20N4O MolecularWeight: 368.4311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CCC#N)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CCC#N)/C#N)C

InChI

InChI=1S/C23H20N4O/c1-16-8-9-20(12-17(16)2)26-23(28)18(14-25)13-19-15-27(11-5-10-24)22-7-4-3-6-21(19)22/h3-4,6-9,12-13,15H,5,11H2,1-2H3,(H,26,28)/b18-13+