(3-methyl-1,2-oxazol-5-yl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate Openeye Name: (3-methylisoxazol-5-yl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate CAS Name: (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoic acid (3-methyl-5-isoxazolyl)methyl ester IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoate Traditional Name: (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propionic acid (3-methylisoxazol-5-yl)methyl ester Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)COC(=O)C(C)(CC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

CC1=NOC(=C1)COC(=O)[C@](C)(CC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S/c1-15-12-17(27-24-15)14-26-21(25)22(2,16-8-4-3-5-9-16)13-20-23-18-10-6-7-11-19(18)28-20/h3-12H,13-14H2,1-2H3/t22-/m1/s1