(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 2-[(4-tert-butylbenzoyl)amino]acetate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]acetic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-[(4-tert-butylbenzoyl)amino]acetate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]acetic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=COC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=COC(=N2)C3=CC=CS3

InChI

InChI=1S/C21H22N2O4S/c1-21(2,3)15-8-6-14(7-9-15)19(25)22-11-18(24)26-12-16-13-27-20(23-16)17-5-4-10-28-17/h4-10,13H,11-12H2,1-3H3,(H,22,25)