[2-(4-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-(4-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [2-(4-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [2-(4-chlorophenyl)-5-(3,4-dimethylphenyl)-3-pyrazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-(4-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [2-(4-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-pyrrolidino-methanone Formula: C22H22ClN3O MolecularWeight: 379.88258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)N3CCCC3)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)N3CCCC3)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H22ClN3O/c1-15-5-6-17(13-16(15)2)20-14-21(22(27)25-11-3-4-12-25)26(24-20)19-9-7-18(23)8-10-19/h5-10,13-14H,3-4,11-12H2,1-2H3