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

Systemtic Name: 5-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-cyclobutylcarbonyl-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxamide Openeye Name: 5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(cyclobutanecarbonyl)-4-(2-methylbenzoyl)-3-(3-methyl-2-thienyl)pyrrolidine-2-carboxamide CAS Name: 5-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-[cyclobutyl(oxo)methyl]-4-[(2-methylphenyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxamide IUPAC Name: 5-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(cyclobutanecarbonyl)-4-(2-methylbenzoyl)-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxamide Traditional Name: 5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(cyclobutanecarbonyl)-3-(3-methyl-2-thienyl)-4-o-toluoyl-pyrrolidine-2-carboxamide Formula: C28H31ClN4O3S MolecularWeight: 539.08874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)N)C(=O)C3CCC3)C4=C(N(N=C4C)C)Cl)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)N)C(=O)C3CCC3)C4=C(N(N=C4C)C)Cl)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C28H31ClN4O3S/c1-14-8-5-6-11-18(14)24(34)20-21(25-15(2)12-13-37-25)23(27(30)35)33(28(36)17-9-7-10-17)22(20)19-16(3)31-32(4)26(19)29/h5-6,8,11-13,17,20-23H,7,9-10H2,1-4H3,(H2,30,35)