(2S,3R)-3-oxidanyl-1-[(4S)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-propan-2-yl-octan-1-one

Systemtic Name: (2S,3R)-3-oxidanyl-1-[(4S)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-propan-2-yl-octan-1-one Openeye Name: (2S,3R)-3-hydroxy-2-isopropyl-1-[(4S)-4-phenyl-2-thioxo-thiazolidin-3-yl]octan-1-one CAS Name: (2S,3R)-3-hydroxy-1-[(4S)-4-phenyl-2-sulfanylidene-3-thiazolidinyl]-2-propan-2-yl-1-octanone IUPAC Name: (2S,3R)-3-hydroxy-1-[(4S)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-propan-2-yloctan-1-one Traditional Name: (2S,3R)-3-hydroxy-2-isopropyl-1-[(4S)-4-phenyl-2-thioxo-thiazolidin-3-yl]octan-1-one Formula: C20H29NO2S2 MolecularWeight: 379.57976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C(C)C)C(=O)N1C(CSC1=S)C2=CC=CC=C2)O

Isomeric SMILES

CCCCC[C@H]([C@H](C(C)C)C(=O)N1[C@H](CSC1=S)C2=CC=CC=C2)O

InChI

InChI=1S/C20H29NO2S2/c1-4-5-7-12-17(22)18(14(2)3)19(23)21-16(13-25-20(21)24)15-10-8-6-9-11-15/h6,8-11,14,16-18,22H,4-5,7,12-13H2,1-3H3/t16-,17-,18+/m1/s1