(E)-3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide

Systemtic Name: (E)-3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide Openeye Name: (E)-3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: (E)-3-[3-(3-bromophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-cyclopropyl-2-propenamide IUPAC Name: (E)-3-[3-(3-bromophenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: (E)-3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclopropyl-acrylamide Formula: C22H17BrN4O MolecularWeight: 433.30058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)Br)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CC1NC(=O)/C(=C/C2=CN(N=C2C3=CC(=CC=C3)Br)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C22H17BrN4O/c23-18-6-4-5-15(12-18)21-17(11-16(13-24)22(28)25-19-9-10-19)14-27(26-21)20-7-2-1-3-8-20/h1-8,11-12,14,19H,9-10H2,(H,25,28)/b16-11+