3-(4-chlorophenyl)-1-(3,3-dimethylbutanoyl)-5-phenyl-N-prop-2-enyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-1-(3,3-dimethylbutanoyl)-5-phenyl-N-prop-2-enyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-allyl-3-(4-chlorophenyl)-1-(3,3-dimethylbutanoyl)-5-phenyl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: 3-(4-chlorophenyl)-1-(3,3-dimethyl-1-oxobutyl)-4-[oxo(thiophen-2-yl)methyl]-5-phenyl-N-prop-2-enyl-2-pyrrolidinecarboxamide IUPAC Name: 3-(4-chlorophenyl)-1-(3,3-dimethylbutanoyl)-5-phenyl-N-prop-2-enyl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-allyl-3-(4-chlorophenyl)-1-(3,3-dimethylbutanoyl)-5-phenyl-4-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C31H33ClN2O3S MolecularWeight: 549.12332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1C(C(C(C1C(=O)NCC=C)C2=CC=C(C=C2)Cl)C(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC(=O)N1C(C(C(C1C(=O)NCC=C)C2=CC=C(C=C2)Cl)C(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C31H33ClN2O3S/c1-5-17-33-30(37)28-25(20-13-15-22(32)16-14-20)26(29(36)23-12-9-18-38-23)27(21-10-7-6-8-11-21)34(28)24(35)19-31(2,3)4/h5-16,18,25-28H,1,17,19H2,2-4H3,(H,33,37)