5-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-cyclopropylcarbonyl-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: 5-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-cyclopropylcarbonyl-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: 5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(cyclopropanecarbonyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: 5-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-[cyclopropyl(oxo)methyl]-3-(4-fluorophenyl)-4-[(3-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: 5-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(cyclopropanecarbonyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: 5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(cyclopropanecarbonyl)-3-(4-fluorophenyl)-4-m-toluoyl-pyrrolidine-2-carboxamide Formula: C28H28ClFN4O3 MolecularWeight: 522.998323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=C(N(N=C3C)C)Cl)C(=O)C4CC4)C(=O)N)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=C(N(N=C3C)C)Cl)C(=O)C4CC4)C(=O)N)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H28ClFN4O3/c1-14-5-4-6-18(13-14)25(35)22-21(16-9-11-19(30)12-10-16)24(27(31)36)34(28(37)17-7-8-17)23(22)20-15(2)32-33(3)26(20)29/h4-6,9-13,17,21-24H,7-8H2,1-3H3,(H2,31,36)