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

Systemtic Name: (E)-2-cyano-N-(3,4-dimethylphenyl)-3-[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)indol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(3,4-dimethylphenyl)-3-[1-(2-oxo-2-pyrrolidin-1-yl-ethyl)indol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3,4-dimethylphenyl)-3-[1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-indolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3,4-dimethylphenyl)-3-[1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(3,4-dimethylphenyl)-3-[1-(2-keto-2-pyrrolidino-ethyl)indol-3-yl]acrylamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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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)CC(=O)N4CCCC4)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CC(=O)N4CCCC4)/C#N)C

InChI

InChI=1S/C26H26N4O2/c1-18-9-10-22(13-19(18)2)28-26(32)20(15-27)14-21-16-30(24-8-4-3-7-23(21)24)17-25(31)29-11-5-6-12-29/h3-4,7-10,13-14,16H,5-6,11-12,17H2,1-2H3,(H,28,32)/b20-14+