(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2R)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2R)-3-methyl-2-(phenylcarbamoylamino)butyric acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=NOC(=C1)C2=CC=CS2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@H](C(=O)OCC1=NOC(=C1)C2=CC=CS2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S/c1-13(2)18(22-20(25)21-14-7-4-3-5-8-14)19(24)26-12-15-11-16(27-23-15)17-9-6-10-28-17/h3-11,13,18H,12H2,1-2H3,(H2,21,22,25)/t18-/m1/s1