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

Systemtic Name: (3E)-2-methylsulfanyl-5,6-bis(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole Openeye Name: (1E)-5,6-dibenzyl-1-benzylidene-2-methylsulfanyl-isoindoline CAS Name: (3E)-2-(methylthio)-5,6-bis(phenylmethyl)-3-(phenylmethylene)-1H-isoindole IUPAC Name: (3E)-5,6-dibenzyl-3-benzylidene-2-methylsulfanyl-1H-isoindole Traditional Name: (1E)-1-benzal-5,6-dibenzyl-2-(methylthio)isoindoline Formula: C30H27NS MolecularWeight: 433.60708

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Descriptors Computed from Structure

Canonical SMILES:

CSN1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CSN\1CC2=CC(=C(C=C2/C1=C\C3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C30H27NS/c1-32-31-22-28-20-26(17-23-11-5-2-6-12-23)27(18-24-13-7-3-8-14-24)21-29(28)30(31)19-25-15-9-4-10-16-25/h2-16,19-21H,17-18,22H2,1H3/b30-19+