(E)-N-(3-chloranyl-4-methyl-phenyl)-2-cyano-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide

Systemtic Name: (E)-N-(3-chloranyl-4-methyl-phenyl)-2-cyano-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide Openeye Name: (E)-N-(3-chloro-4-methyl-phenyl)-2-cyano-3-[1-[2-oxo-2-(1-piperidyl)ethyl]indol-3-yl]prop-2-enamide CAS Name: (E)-N-(3-chloro-4-methylphenyl)-2-cyano-3-[1-[2-oxo-2-(1-piperidinyl)ethyl]-3-indolyl]-2-propenamide IUPAC Name: (E)-N-(3-chloro-4-methylphenyl)-2-cyano-3-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]prop-2-enamide Traditional Name: (E)-N-(3-chloro-4-methyl-phenyl)-2-cyano-3-[1-(2-keto-2-piperidino-ethyl)indol-3-yl]acrylamide Formula: C26H25ClN4O2 MolecularWeight: 460.9553

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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)N4CCCCC4)C#N)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClN4O2/c1-18-9-10-21(14-23(18)27)29-26(33)19(15-28)13-20-16-31(24-8-4-3-7-22(20)24)17-25(32)30-11-5-2-6-12-30/h3-4,7-10,13-14,16H,2,5-6,11-12,17H2,1H3,(H,29,33)/b19-13+