5-phenyl-1-[2-[(3-phenylmethoxycarbonylphenyl)carbamoylamino]ethanoyl]-4-(phenylsulfonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-phenyl-1-[2-[(3-phenylmethoxycarbonylphenyl)carbamoylamino]ethanoyl]-4-(phenylsulfonyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(benzenesulfonyl)-1-[2-[(3-benzyloxycarbonylphenyl)carbamoylamino]acetyl]-5-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 4-(benzenesulfonyl)-1-[1-oxo-2-[[oxo-(3-phenylmethoxycarbonylanilino)methyl]amino]ethyl]-5-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(benzenesulfonyl)-5-phenyl-1-[2-[(3-phenylmethoxycarbonylphenyl)carbamoylamino]acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-besyl-1-[2-[(3-carbobenzoxyphenyl)carbamoylamino]acetyl]-5-phenyl-proline Formula: C34H31N3O8S MolecularWeight: 641.69024

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1C(=O)O)C(=O)CNC(=O)NC2=CC=CC(=C2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1C(C(N(C1C(=O)O)C(=O)CNC(=O)NC2=CC=CC(=C2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C34H31N3O8S/c38-30(21-35-34(42)36-26-16-10-15-25(19-26)33(41)45-22-23-11-4-1-5-12-23)37-28(32(39)40)20-29(31(37)24-13-6-2-7-14-24)46(43,44)27-17-8-3-9-18-27/h1-19,28-29,31H,20-22H2,(H,39,40)(H2,35,36,42)