tert-butyl 4-[(2S)-2-[(3-ethanoyl-1,3-thiazolidin-4-yl)carbonylamino]-3-methoxy-3-oxidanylidene-propyl]benzoate

Systemtic Name: tert-butyl 4-[(2S)-2-[(3-ethanoyl-1,3-thiazolidin-4-yl)carbonylamino]-3-methoxy-3-oxidanylidene-propyl]benzoate Openeye Name: tert-butyl 4-[(2S)-2-[(3-acetylthiazolidine-4-carbonyl)amino]-3-methoxy-3-oxo-propyl]benzoate CAS Name: 4-[(2S)-2-[[(3-acetyl-4-thiazolidinyl)-oxomethyl]amino]-3-methoxy-3-oxopropyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S)-2-[(3-acetyl-1,3-thiazolidine-4-carbonyl)amino]-3-methoxy-3-oxopropyl]benzoate Traditional Name: 4-[(2S)-2-[(3-acetylthiazolidine-4-carbonyl)amino]-3-keto-3-methoxy-propyl]benzoic acid tert-butyl ester Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CSCC1C(=O)NC(CC2=CC=C(C=C2)C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC(=O)N1CSCC1C(=O)N[C@@H](CC2=CC=C(C=C2)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C21H28N2O6S/c1-13(24)23-12-30-11-17(23)18(25)22-16(20(27)28-5)10-14-6-8-15(9-7-14)19(26)29-21(2,3)4/h6-9,16-17H,10-12H2,1-5H3,(H,22,25)/t16-,17?/m0/s1