(3E)-2-ethoxy-5-methylsulfanyl-6-(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole

Systemtic Name: (3E)-2-ethoxy-5-methylsulfanyl-6-(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole Openeye Name: (1E)-5-benzyl-1-benzylidene-2-ethoxy-6-methylsulfanyl-isoindoline CAS Name: (3E)-2-ethoxy-5-(methylthio)-6-(phenylmethyl)-3-(phenylmethylene)-1H-isoindole IUPAC Name: (3E)-6-benzyl-3-benzylidene-2-ethoxy-5-methylsulfanyl-1H-isoindole Traditional Name: (1E)-1-benzal-5-benzyl-2-ethoxy-6-(methylthio)isoindoline Formula: C25H25NOS MolecularWeight: 387.5371

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Descriptors Computed from Structure

Canonical SMILES:

CCON1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)SC)CC4=CC=CC=C4

Isomeric SMILES

CCON\1CC2=CC(=C(C=C2/C1=C\C3=CC=CC=C3)SC)CC4=CC=CC=C4

InChI

InChI=1S/C25H25NOS/c1-3-27-26-18-22-16-21(14-19-10-6-4-7-11-19)25(28-2)17-23(22)24(26)15-20-12-8-5-9-13-20/h4-13,15-17H,3,14,18H2,1-2H3/b24-15+