(E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(1-phenylpyrazol-4-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(1-phenylpyrazol-4-yl)methyl]prop-2-enamide Openeye Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(1-phenylpyrazol-4-yl)methyl]prop-2-enamide CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-N-[(1-phenyl-4-pyrazolyl)methyl]-2-propenamide IUPAC Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(1-phenylpyrazol-4-yl)methyl]prop-2-enamide Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(1-phenylpyrazol-4-yl)methyl]acrylamide Formula: C24H21N5O MolecularWeight: 395.45644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C=CC3=CN(C4=CC=CC=C43)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)/C=C/C3=CN(C4=CC=CC=C43)CCC#N

InChI

InChI=1S/C24H21N5O/c25-13-6-14-28-18-20(22-9-4-5-10-23(22)28)11-12-24(30)26-15-19-16-27-29(17-19)21-7-2-1-3-8-21/h1-5,7-12,16-18H,6,14-15H2,(H,26,30)/b12-11+