(E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(1-methylpyrazol-3-yl)prop-2-enamide

Systemtic Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(1-methylpyrazol-3-yl)prop-2-enamide Openeye Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(1-methylpyrazol-3-yl)prop-2-enamide CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-N-(1-methyl-3-pyrazolyl)-2-propenamide IUPAC Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(1-methylpyrazol-3-yl)prop-2-enamide Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(1-methylpyrazol-3-yl)acrylamide Formula: C18H17N5O MolecularWeight: 319.36048

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C=CC2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

CN1C=CC(=N1)NC(=O)/C=C/C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C18H17N5O/c1-22-12-9-17(21-22)20-18(24)8-7-14-13-23(11-4-10-19)16-6-3-2-5-15(14)16/h2-3,5-9,12-13H,4,11H2,1H3,(H,20,21,24)/b8-7+