3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide

Systemtic Name: 3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide Openeye Name: 3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: 3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-cyclopropyl-2-propenamide IUPAC Name: 3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: 3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-cyclopropyl-acrylamide Formula: C16H13ClN4O MolecularWeight: 312.75362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1CC1NC(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C16H13ClN4O/c17-13-3-1-10(2-4-13)15-12(9-19-21-15)7-11(8-18)16(22)20-14-5-6-14/h1-4,7,9,14H,5-6H2,(H,19,21)(H,20,22)