1-[(2R,4aR,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[(2R,4aR,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 1-[(2R,4aR,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl]-2-benzylsulfanyl-ethanone CAS Name: 1-[(2R,4aR,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl]-2-(phenylmethylthio)ethanone IUPAC Name: 1-[(2R,4aR,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl]-2-benzylsulfanylethanone Traditional Name: 1-[(2R,4aR,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl]-2-(benzylthio)ethanone Formula: C20H28O2S2 MolecularWeight: 364.56512

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(C1)OC(SC2(C)C)C(=O)CSCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC[C@@H]2[C@@H](C1)O[C@H](SC2(C)C)C(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C20H28O2S2/c1-14-9-10-16-18(11-14)22-19(24-20(16,2)3)17(21)13-23-12-15-7-5-4-6-8-15/h4-8,14,16,18-19H,9-13H2,1-3H3/t14-,16-,18-,19-/m1/s1