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

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=COC(=N1)C2=CC=CS2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=COC(=N1)C2=CC=CS2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H28N2O4S/c1-15(2)20(26-21(27)16-8-10-17(11-9-16)24(3,4)5)23(28)30-14-18-13-29-22(25-18)19-7-6-12-31-19/h6-13,15,20H,14H2,1-5H3,(H,26,27)/t20-/m0/s1