N-[2-tert-butylsulfanyl-6-(3-oxidanyl-3-phenyl-propyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide

Systemtic Name: N-[2-tert-butylsulfanyl-6-(3-oxidanyl-3-phenyl-propyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide Openeye Name: N-[2-tert-butylsulfanyl-6-(3-hydroxy-3-phenyl-propyl)phenyl]-2-(9H-xanthen-9-yl)acetamide CAS Name: N-[2-(tert-butylthio)-6-(3-hydroxy-3-phenylpropyl)phenyl]-2-(9H-xanthen-9-yl)acetamide IUPAC Name: N-[2-tert-butylsulfanyl-6-(3-hydroxy-3-phenylpropyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Traditional Name: N-[2-(tert-butylthio)-6-(3-hydroxy-3-phenyl-propyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Formula: C34H35NO3S MolecularWeight: 537.7116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC=CC(=C1NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24)CCC(C5=CC=CC=C5)O

Isomeric SMILES

CC(C)(C)SC1=CC=CC(=C1NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24)CCC(C5=CC=CC=C5)O

InChI

InChI=1S/C34H35NO3S/c1-34(2,3)39-31-19-11-14-24(20-21-28(36)23-12-5-4-6-13-23)33(31)35-32(37)22-27-25-15-7-9-17-29(25)38-30-18-10-8-16-26(27)30/h4-19,27-28,36H,20-22H2,1-3H3,(H,35,37)