2-methylpropyl (2S,4R)-2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: 2-methylpropyl (2S,4R)-2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: isobutyl (2S,4R)-4-hydroxy-2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S,4R)-4-hydroxy-2-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2S,4R)-4-hydroxy-2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-hydroxy-2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid isobutyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4CC(CN4C(=O)OCC(C)C)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)[C@@H]4C[C@H](CN4C(=O)OCC(C)C)O

InChI

InChI=1S/C24H27N3O4S/c1-14(2)13-31-24(30)27-12-18(28)11-20(27)22(29)25-17-7-5-16(6-8-17)23-26-19-9-4-15(3)10-21(19)32-23/h4-10,14,18,20,28H,11-13H2,1-3H3,(H,25,29)/t18-,20+/m1/s1