(E)-3-(4-acetamidophenyl)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(4-acetamidophenyl)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-prop-2-enamide Openeye Name: (E)-3-(4-acetamidophenyl)-2-cyano-N-[4-[(1S)-1-methylpropyl]phenyl]prop-2-enamide CAS Name: (E)-3-(4-acetamidophenyl)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-2-propenamide IUPAC Name: (E)-3-(4-acetamidophenyl)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyanoprop-2-enamide Traditional Name: (E)-3-(4-acetamidophenyl)-2-cyano-N-[4-[(1S)-1-methylpropyl]phenyl]acrylamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)NC(=O)C)C#N

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)NC(=O)C)/C#N

InChI

InChI=1S/C22H23N3O2/c1-4-15(2)18-7-11-21(12-8-18)25-22(27)19(14-23)13-17-5-9-20(10-6-17)24-16(3)26/h5-13,15H,4H2,1-3H3,(H,24,26)(H,25,27)/b19-13+/t15-/m0/s1