5-[(1S,2S,3R)-4,4-bis(ethylsulfanyl)-1,2,3-tris(phenylmethoxy)butyl]-1H-imidazole

Systemtic Name: 5-[(1S,2S,3R)-4,4-bis(ethylsulfanyl)-1,2,3-tris(phenylmethoxy)butyl]-1H-imidazole Openeye Name: 5-[(1S,2S,3R)-1,2,3-tribenzyloxy-4,4-bis(ethylsulfanyl)butyl]-1H-imidazole CAS Name: 5-[(1S,2S,3R)-4,4-bis(ethylthio)-1,2,3-tris(phenylmethoxy)butyl]-1H-imidazole IUPAC Name: 5-[(1S,2S,3R)-4,4-bis(ethylsulfanyl)-1,2,3-tris(phenylmethoxy)butyl]-1H-imidazole Traditional Name: 5-[(1S,2S,3R)-1,2,3-tribenzoxy-4,4-bis(ethylthio)butyl]-1H-imidazole Formula: C32H38N2O3S2 MolecularWeight: 562.78572

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C(C(C(C1=CN=CN1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)SCC

Isomeric SMILES

CCSC([C@@H]([C@H]([C@H](C1=CN=CN1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)SCC

InChI

InChI=1S/C32H38N2O3S2/c1-3-38-32(39-4-2)31(37-23-27-18-12-7-13-19-27)30(36-22-26-16-10-6-11-17-26)29(28-20-33-24-34-28)35-21-25-14-8-5-9-15-25/h5-20,24,29-32H,3-4,21-23H2,1-2H3,(H,33,34)/t29-,30-,31+/m0/s1