(phenylmethyl) N-[(1R,2R)-1-(1,3-dithian-2-yl)-1-oxidanyl-3-phenylsulfanyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(1R,2R)-1-(1,3-dithian-2-yl)-1-oxidanyl-3-phenylsulfanyl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1R,2R)-2-(1,3-dithian-2-yl)-2-hydroxy-1-(phenylsulfanylmethyl)ethyl]carbamate CAS Name: N-[(1R,2R)-1-(1,3-dithian-2-yl)-1-hydroxy-3-(phenylthio)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(1R,2R)-1-(1,3-dithian-2-yl)-1-hydroxy-3-phenylsulfanylpropan-2-yl]carbamate Traditional Name: N-[(1R,2R)-2-(1,3-dithian-2-yl)-2-hydroxy-1-[(phenylthio)methyl]ethyl]carbamic acid benzyl ester Formula: C21H25NO3S3 MolecularWeight: 435.6231

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C(C(CSC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

C1CSC(SC1)[C@@H]([C@H](CSC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C21H25NO3S3/c23-19(20-26-12-7-13-27-20)18(15-28-17-10-5-2-6-11-17)22-21(24)25-14-16-8-3-1-4-9-16/h1-6,8-11,18-20,23H,7,12-15H2,(H,22,24)/t18-,19+/m0/s1