(E)-3-[1-(2-azanyl-2-oxidanylidene-ethyl)indol-3-yl]-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-[1-(2-azanyl-2-oxidanylidene-ethyl)indol-3-yl]-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-[1-(2-amino-2-oxo-ethyl)indol-3-yl]-N-(5-chloro-2-methyl-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-[1-(2-amino-2-oxoethyl)-3-indolyl]-N-(5-chloro-2-methylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-[1-(2-amino-2-oxoethyl)indol-3-yl]-N-(5-chloro-2-methylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-[1-(2-amino-2-keto-ethyl)indol-3-yl]-N-(5-chloro-2-methyl-phenyl)-2-cyano-acrylamide Formula: C21H17ClN4O2 MolecularWeight: 392.83828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN4O2/c1-13-6-7-16(22)9-18(13)25-21(28)14(10-23)8-15-11-26(12-20(24)27)19-5-3-2-4-17(15)19/h2-9,11H,12H2,1H3,(H2,24,27)(H,25,28)/b14-8+