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

Systemtic Name: 5-(4-cyanophenyl)-2-methyl-4-(5-methylfuran-2-yl)carbonyl-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-cyanophenyl)-2-methyl-4-(5-methylfuran-2-carbonyl)-3-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-5-(4-cyanophenyl)-2-methyl-4-[(5-methyl-2-furanyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-cyanophenyl)-2-methyl-4-(5-methylfuran-2-carbonyl)-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-cyanophenyl)-2-methyl-4-(5-methyl-2-furoyl)-3-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)proline Formula: C31H27N3O5S MolecularWeight: 553.62818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2(C)C(=O)O)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)C#N)C(=O)C5=CC=C(O5)C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2(C)C(=O)O)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)C#N)C(=O)C5=CC=C(O5)C

InChI

InChI=1S/C31H27N3O5S/c1-18-15-16-40-28(18)25-24(27(35)23-14-9-19(2)39-23)26(21-12-10-20(17-32)11-13-21)34(31(25,3)29(36)37)30(38)33-22-7-5-4-6-8-22/h4-16,24-26H,1-3H3,(H,33,38)(H,36,37)