N-(5-isothiocyanato-2-oxidanyl-phenyl)-2-[2-(triphenylmethyl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(5-isothiocyanato-2-oxidanyl-phenyl)-2-[2-(triphenylmethyl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2-hydroxy-5-isothiocyanato-phenyl)-2-[(2-tritylsulfanylacetyl)amino]acetamide CAS Name: N-(2-hydroxy-5-isothiocyanatophenyl)-2-[[1-oxo-2-[(triphenylmethyl)thio]ethyl]amino]acetamide IUPAC Name: N-(2-hydroxy-5-isothiocyanatophenyl)-2-[(2-tritylsulfanylacetyl)amino]acetamide Traditional Name: N-(2-hydroxy-5-isothiocyanato-phenyl)-2-[[2-(tritylthio)acetyl]amino]acetamide Formula: C30H25N3O3S2 MolecularWeight: 539.6678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(=O)NCC(=O)NC4=C(C=CC(=C4)N=C=S)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(=O)NCC(=O)NC4=C(C=CC(=C4)N=C=S)O

InChI

InChI=1S/C30H25N3O3S2/c34-27-17-16-25(32-21-37)18-26(27)33-28(35)19-31-29(36)20-38-30(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-18,34H,19-20H2,(H,31,36)(H,33,35)