3-[3-[4-[(2-chlorophenyl)methoxy]phenyl]-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclohexyl-prop-2-enamide

Systemtic Name: 3-[3-[4-[(2-chlorophenyl)methoxy]phenyl]-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclohexyl-prop-2-enamide Openeye Name: 3-[3-[4-[(2-chlorophenyl)methoxy]phenyl]-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclohexyl-prop-2-enamide CAS Name: 3-[3-[4-[(2-chlorophenyl)methoxy]phenyl]-1-phenyl-4-pyrazolyl]-2-cyano-N-cyclohexyl-2-propenamide IUPAC Name: 3-[3-[4-[(2-chlorophenyl)methoxy]phenyl]-1-phenylpyrazol-4-yl]-2-cyano-N-cyclohexylprop-2-enamide Traditional Name: 3-[3-[4-(2-chlorobenzyl)oxyphenyl]-1-phenyl-pyrazol-4-yl]-2-cyano-N-cyclohexyl-acrylamide Formula: C32H29ClN4O2 MolecularWeight: 537.05126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C5=CC=CC=C5)C#N

InChI

InChI=1S/C32H29ClN4O2/c33-30-14-8-7-9-24(30)22-39-29-17-15-23(16-18-29)31-26(21-37(36-31)28-12-5-2-6-13-28)19-25(20-34)32(38)35-27-10-3-1-4-11-27/h2,5-9,12-19,21,27H,1,3-4,10-11,22H2,(H,35,38)