tert-butyl N-[(1S,2R)-1-(4-bromanyl-1,3-thiazol-2-yl)-2-oxidanyl-2-phenyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1S,2R)-1-(4-bromanyl-1,3-thiazol-2-yl)-2-oxidanyl-2-phenyl-ethyl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-1-(4-bromothiazol-2-yl)-2-hydroxy-2-phenyl-ethyl]carbamate CAS Name: N-[(1S,2R)-1-(4-bromo-2-thiazolyl)-2-hydroxy-2-phenylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S,2R)-1-(4-bromo-1,3-thiazol-2-yl)-2-hydroxy-2-phenylethyl]carbamate Traditional Name: N-[(1S,2R)-1-(4-bromothiazol-2-yl)-2-hydroxy-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C16H19BrN2O3S MolecularWeight: 399.30266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=NC(=CS1)Br)C(C2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C1=NC(=CS1)Br)[C@@H](C2=CC=CC=C2)O

InChI

InChI=1S/C16H19BrN2O3S/c1-16(2,3)22-15(21)19-12(14-18-11(17)9-23-14)13(20)10-7-5-4-6-8-10/h4-9,12-13,20H,1-3H3,(H,19,21)/t12-,13+/m0/s1