(E)-2-cyano-N-(2,5-dimethylphenyl)-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,5-dimethylphenyl)-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,5-dimethylphenyl)-3-[1-[2-oxo-2-(1-piperidyl)ethyl]indol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(2,5-dimethylphenyl)-3-[1-[2-oxo-2-(1-piperidinyl)ethyl]-3-indolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,5-dimethylphenyl)-3-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,5-dimethylphenyl)-3-[1-(2-keto-2-piperidino-ethyl)indol-3-yl]acrylamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4)/C#N

InChI

InChI=1S/C27H28N4O2/c1-19-10-11-20(2)24(14-19)29-27(33)21(16-28)15-22-17-31(25-9-5-4-8-23(22)25)18-26(32)30-12-6-3-7-13-30/h4-5,8-11,14-15,17H,3,6-7,12-13,18H2,1-2H3,(H,29,33)/b21-15+