tert-butyl 2-butyl-3-[2-[[3-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)phenyl]carbamoylamino]ethanoyl]-1,3-thiazolidine-2-carboxylate

Systemtic Name: tert-butyl 2-butyl-3-[2-[[3-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)phenyl]carbamoylamino]ethanoyl]-1,3-thiazolidine-2-carboxylate Openeye Name: tert-butyl 3-[2-[[3-(2-benzyloxy-1-methyl-2-oxo-ethyl)phenyl]carbamoylamino]acetyl]-2-butyl-thiazolidine-2-carboxylate CAS Name: 2-butyl-3-[1-oxo-2-[[oxo-[3-(1-oxo-1-phenylmethoxypropan-2-yl)anilino]methyl]amino]ethyl]-2-thiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-butyl-3-[2-[[3-(1-oxo-1-phenylmethoxypropan-2-yl)phenyl]carbamoylamino]acetyl]-1,3-thiazolidine-2-carboxylate Traditional Name: 3-[2-[[3-(2-benzoxy-2-keto-1-methyl-ethyl)phenyl]carbamoylamino]acetyl]-2-butyl-thiazolidine-2-carboxylic acid tert-butyl ester Formula: C31H41N3O6S MolecularWeight: 583.73874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(N(CCS1)C(=O)CNC(=O)NC2=CC=CC(=C2)C(C)C(=O)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1(N(CCS1)C(=O)CNC(=O)NC2=CC=CC(=C2)C(C)C(=O)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H41N3O6S/c1-6-7-16-31(28(37)40-30(3,4)5)34(17-18-41-31)26(35)20-32-29(38)33-25-15-11-14-24(19-25)22(2)27(36)39-21-23-12-9-8-10-13-23/h8-15,19,22H,6-7,16-18,20-21H2,1-5H3,(H2,32,33,38)