2-cyano-N-cycloheptyl-3-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]prop-2-enamide

Systemtic Name: 2-cyano-N-cycloheptyl-3-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]prop-2-enamide Openeye Name: 2-cyano-N-cycloheptyl-3-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]prop-2-enamide CAS Name: 2-cyano-N-cycloheptyl-3-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-2-propenamide IUPAC Name: 2-cyano-N-cycloheptyl-3-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]prop-2-enamide Traditional Name: 2-cyano-N-cycloheptyl-3-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]acrylamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NC3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NC3CCCCCC3)OC

InChI

InChI=1S/C22H26N4O3/c1-28-19-10-9-15(12-20(19)29-2)21-17(14-24-26-21)11-16(13-23)22(27)25-18-7-5-3-4-6-8-18/h9-12,14,18H,3-8H2,1-2H3,(H,24,26)(H,25,27)