tert-butyl (4S)-4-[(2R)-2-(2-cyanothiophen-3-yl)sulfanyl-2-phenyl-ethyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S)-4-[(2R)-2-(2-cyanothiophen-3-yl)sulfanyl-2-phenyl-ethyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S)-4-[(2R)-2-[(2-cyano-3-thienyl)sulfanyl]-2-phenyl-ethyl]-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(2R)-2-[(2-cyano-3-thiophenyl)thio]-2-phenylethyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-[(2R)-2-(2-cyanothiophen-3-yl)sulfanyl-2-phenylethyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-[(2R)-2-[(2-cyano-3-thienyl)thio]-2-phenyl-ethyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C23H28N2O3S2 MolecularWeight: 444.61002

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C(CO1)CC(C2=CC=CC=C2)SC3=C(SC=C3)C#N)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(N([C@H](CO1)C[C@H](C2=CC=CC=C2)SC3=C(SC=C3)C#N)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C23H28N2O3S2/c1-22(2,3)28-21(26)25-17(15-27-23(25,4)5)13-19(16-9-7-6-8-10-16)30-18-11-12-29-20(18)14-24/h6-12,17,19H,13,15H2,1-5H3/t17-,19+/m0/s1