N-(3-chloranyl-4-propan-2-yloxy-phenyl)-3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanamide

Systemtic Name: N-(3-chloranyl-4-propan-2-yloxy-phenyl)-3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanamide Openeye Name: N-(3-chloro-4-isopropoxy-phenyl)-3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: N-(3-chloro-4-propan-2-yloxyphenyl)-3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: N-(3-chloro-4-propan-2-yloxyphenyl)-3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]propanamide Traditional Name: N-(3-chloro-4-isopropoxy-phenyl)-3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propionamide Formula: C20H25ClN4O2 MolecularWeight: 388.8911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC(=C(C=C2)OC(C)C)Cl

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC(=C(C=C2)OC(C)C)Cl

InChI

InChI=1S/C20H25ClN4O2/c1-13(2)27-19-8-6-16(12-18(19)21)23-20(26)9-7-17-14(3)24-25(15(17)4)11-5-10-22/h6,8,12-13H,5,7,9,11H2,1-4H3,(H,23,26)