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

Systemtic Name: (3E)-6-chloranyl-2,5-bis(methylsulfanyl)-3-(phenylmethylidene)-1H-isoindole Openeye Name: (1E)-1-benzylidene-5-chloro-2,6-bis(methylsulfanyl)isoindoline CAS Name: (3E)-6-chloro-2,5-bis(methylthio)-3-(phenylmethylene)-1H-isoindole IUPAC Name: (3E)-3-benzylidene-6-chloro-2,5-bis(methylsulfanyl)-1H-isoindole Traditional Name: (1E)-1-benzal-5-chloro-2,6-bis(methylthio)isoindoline Formula: C17H16ClNS2 MolecularWeight: 333.89864

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C2CN(C(=CC3=CC=CC=C3)C2=C1)SC)Cl

Isomeric SMILES

CSC1=C(C=C2CN(/C(=C/C3=CC=CC=C3)/C2=C1)SC)Cl

InChI

InChI=1S/C17H16ClNS2/c1-20-17-10-14-13(9-15(17)18)11-19(21-2)16(14)8-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3/b16-8+