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

Systemtic Name: 3-(4-acetamidophenyl)-5-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-cyclopropylcarbonyl-4-(2,5-dimethylthiophen-3-yl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: 3-(4-acetamidophenyl)-5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(cyclopropanecarbonyl)-4-(2,5-dimethylthiophene-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: 3-(4-acetamidophenyl)-5-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-[cyclopropyl(oxo)methyl]-4-[(2,5-dimethyl-3-thiophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: 3-(4-acetamidophenyl)-5-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(cyclopropanecarbonyl)-4-(2,5-dimethylthiophene-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: 3-(4-acetamidophenyl)-5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(cyclopropanecarbonyl)-4-(2,5-dimethylthiophene-3-carbonyl)pyrrolidine-2-carboxamide Formula: C29H32ClN5O4S MolecularWeight: 582.11348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)C2C(C(N(C2C3=C(N(N=C3C)C)Cl)C(=O)C4CC4)C(=O)N)C5=CC=C(C=C5)NC(=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)C2C(C(N(C2C3=C(N(N=C3C)C)Cl)C(=O)C4CC4)C(=O)N)C5=CC=C(C=C5)NC(=O)C

InChI

InChI=1S/C29H32ClN5O4S/c1-13-12-20(15(3)40-13)26(37)23-22(17-8-10-19(11-9-17)32-16(4)36)25(28(31)38)35(29(39)18-6-7-18)24(23)21-14(2)33-34(5)27(21)30/h8-12,18,22-25H,6-7H2,1-5H3,(H2,31,38)(H,32,36)