5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-4-(5-methylfuran-2-yl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-4-(5-methylfuran-2-yl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-4-(5-methylfuran-2-carbonyl)-3-(3-methyl-2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-methoxyphenyl)-2-methyl-4-[(5-methyl-2-furanyl)-oxomethyl]-1-(3-methyl-1-oxobutyl)-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-4-(5-methylfuran-2-carbonyl)-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-isovaleryl-5-(4-methoxyphenyl)-2-methyl-4-(5-methyl-2-furoyl)-3-(3-methyl-2-thienyl)proline Formula: C29H33NO6S MolecularWeight: 523.64042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2(C)C(=O)O)C(=O)CC(C)C)C3=CC=C(C=C3)OC)C(=O)C4=CC=C(O4)C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2(C)C(=O)O)C(=O)CC(C)C)C3=CC=C(C=C3)OC)C(=O)C4=CC=C(O4)C

InChI

InChI=1S/C29H33NO6S/c1-16(2)15-22(31)30-25(19-8-10-20(35-6)11-9-19)23(26(32)21-12-7-18(4)36-21)24(29(30,5)28(33)34)27-17(3)13-14-37-27/h7-14,16,23-25H,15H2,1-6H3,(H,33,34)