4-(5-methylfuran-2-yl)carbonyl-1-[(3-methylphenyl)carbamoyl]-3-(3-methylthiophen-2-yl)-5-pyridin-3-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(5-methylfuran-2-yl)carbonyl-1-[(3-methylphenyl)carbamoyl]-3-(3-methylthiophen-2-yl)-5-pyridin-3-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(5-methylfuran-2-carbonyl)-3-(3-methyl-2-thienyl)-1-(m-tolylcarbamoyl)-5-(3-pyridyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methylanilino)-oxomethyl]-4-[(5-methyl-2-furanyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-5-(3-pyridinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(5-methylfuran-2-carbonyl)-1-[(3-methylphenyl)carbamoyl]-3-(3-methylthiophen-2-yl)-5-pyridin-3-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(5-methyl-2-furoyl)-3-(3-methyl-2-thienyl)-1-(m-tolylcarbamoyl)-5-(3-pyridyl)proline Formula: C29H27N3O5S MolecularWeight: 529.60678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)O)C3=C(C=CS3)C)C(=O)C4=CC=C(O4)C)C5=CN=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)O)C3=C(C=CS3)C)C(=O)C4=CC=C(O4)C)C5=CN=CC=C5

InChI

InChI=1S/C29H27N3O5S/c1-16-6-4-8-20(14-16)31-29(36)32-24(19-7-5-12-30-15-19)22(26(33)21-10-9-18(3)37-21)23(25(32)28(34)35)27-17(2)11-13-38-27/h4-15,22-25H,1-3H3,(H,31,36)(H,34,35)