3-[3-(triphenylmethyl)thiomorpholin-4-yl]-2H-thiete-4-carboxylic acid

Systemtic Name: 3-[3-(triphenylmethyl)thiomorpholin-4-yl]-2H-thiete-4-carboxylic acid Openeye Name: 3-(3-tritylthiomorpholin-4-yl)-2H-thiete-4-carboxylic acid CAS Name: 3-[3-(triphenylmethyl)-4-thiomorpholinyl]-2H-thiete-4-carboxylic acid IUPAC Name: 3-(3-tritylthiomorpholin-4-yl)-2H-thiete-4-carboxylic acid Traditional Name: 3-(3-tritylthiomorpholin-4-yl)-2H-thiete-4-carboxylic acid Formula: C27H25NO2S2 MolecularWeight: 459.6229

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(N1C2=C(SC2)C(=O)O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CSCC(N1C2=C(SC2)C(=O)O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25NO2S2/c29-26(30)25-23(18-32-25)28-16-17-31-19-24(28)27(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,24H,16-19H2,(H,29,30)