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

Systemtic Name: 5-(4-dimethylaminophenyl)-4-(5-methylfuran-2-yl)carbonyl-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-dimethylaminophenyl)-4-(5-methylfuran-2-carbonyl)-3-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-5-(4-dimethylaminophenyl)-4-[(5-methyl-2-furanyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-dimethylaminophenyl)-4-(5-methylfuran-2-carbonyl)-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-dimethylaminophenyl)-4-(5-methyl-2-furoyl)-3-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)proline Formula: C31H31N3O5S MolecularWeight: 557.65994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H31N3O5S/c1-18-16-17-40-29(18)25-24(28(35)23-15-10-19(2)39-23)26(20-11-13-22(14-12-20)33(3)4)34(27(25)30(36)37)31(38)32-21-8-6-5-7-9-21/h5-17,24-27H,1-4H3,(H,32,38)(H,36,37)