3-[1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazol-4-yl]-1-(2-pyridin-2-ylpyrrolidin-1-yl)propan-1-one

Systemtic Name: 3-[1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazol-4-yl]-1-(2-pyridin-2-ylpyrrolidin-1-yl)propan-1-one Openeye Name: 3-[1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazol-4-yl]-1-[2-(2-pyridyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-[1-(4-tert-butylphenyl)-3,5-dimethyl-4-pyrazolyl]-1-[2-(2-pyridinyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-[1-(4-tert-butylphenyl)-3,5-dimethylpyrazol-4-yl]-1-(2-pyridin-2-ylpyrrolidin-1-yl)propan-1-one Traditional Name: 3-[1-(4-tert-butylphenyl)-3,5-dimethyl-pyrazol-4-yl]-1-[2-(2-pyridyl)pyrrolidino]propan-1-one Formula: C27H34N4O MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)C)CCC(=O)N3CCCC3C4=CC=CC=N4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)C)CCC(=O)N3CCCC3C4=CC=CC=N4

InChI

InChI=1S/C27H34N4O/c1-19-23(20(2)31(29-19)22-13-11-21(12-14-22)27(3,4)5)15-16-26(32)30-18-8-10-25(30)24-9-6-7-17-28-24/h6-7,9,11-14,17,25H,8,10,15-16,18H2,1-5H3