S-[(2R)-1-(3,3-dimethylbutoxy)-3-[(4-methoxyphenyl)-diphenyl-methoxy]propan-2-yl] ethanethioate

Systemtic Name: S-[(2R)-1-(3,3-dimethylbutoxy)-3-[(4-methoxyphenyl)-diphenyl-methoxy]propan-2-yl] ethanethioate Openeye Name: S-[(1R)-1-(3,3-dimethylbutoxymethyl)-2-[(4-methoxyphenyl)-diphenyl-methoxy]ethyl] ethanethioate CAS Name: ethanethioic acid S-[(2R)-1-(3,3-dimethylbutoxy)-3-[(4-methoxyphenyl)-diphenylmethoxy]propan-2-yl] ester IUPAC Name: S-[(2R)-1-(3,3-dimethylbutoxy)-3-[(4-methoxyphenyl)-diphenylmethoxy]propan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[(1R)-1-(3,3-dimethylbutoxymethyl)-2-[(4-methoxyphenyl)-diphenyl-methoxy]ethyl] ester Formula: C31H38O4S MolecularWeight: 506.69602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(COCCC(C)(C)C)COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)S[C@H](COCCC(C)(C)C)COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C31H38O4S/c1-24(32)36-29(22-34-21-20-30(2,3)4)23-35-31(25-12-8-6-9-13-25,26-14-10-7-11-15-26)27-16-18-28(33-5)19-17-27/h6-19,29H,20-23H2,1-5H3/t29-/m1/s1