(phenylmethyl) (2R)-2-[[4-(4-benzamidophenyl)-1,3-thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R)-2-[[4-(4-benzamidophenyl)-1,3-thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2R)-2-[[4-(4-benzamidophenyl)thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2R)-2-[[[4-(4-benzamidophenyl)-2-thiazolyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[[4-(4-benzamidophenyl)-1,3-thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2R)-2-[[4-(4-benzamidophenyl)thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C29H26N4O4S MolecularWeight: 526.60614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H26N4O4S/c34-26(22-10-5-2-6-11-22)30-23-15-13-21(14-16-23)24-19-38-28(31-24)32-27(35)25-12-7-17-33(25)29(36)37-18-20-8-3-1-4-9-20/h1-6,8-11,13-16,19,25H,7,12,17-18H2,(H,30,34)(H,31,32,35)/t25-/m1/s1