(E)-[4-[(R)-(4-methylphenyl)sulfinyl]phenyl]-[(2E,4E)-5-[[4-[(R)-(4-methylphenyl)sulfinyl]phenyl]amino]penta-2,4-dienylidene]azanium bromide

Systemtic Name: (E)-[4-[(R)-(4-methylphenyl)sulfinyl]phenyl]-[(2E,4E)-5-[[4-[(R)-(4-methylphenyl)sulfinyl]phenyl]amino]penta-2,4-dienylidene]azanium bromide Openeye Name: (E)-[(2E,4E)-5-[4-[(R)-p-tolylsulfinyl]anilino]penta-2,4-dienylidene]-[4-[(R)-p-tolylsulfinyl]phenyl]ammonium bromide CAS Name: (E)-[(2E,4E)-5-[4-[(R)-(4-methylphenyl)sulfinyl]anilino]penta-2,4-dienylidene]-[4-[(R)-(4-methylphenyl)sulfinyl]phenyl]ammonium bromide IUPAC Name: (E)-[(2E,4E)-5-[4-[(R)-(4-methylphenyl)sulfinyl]anilino]penta-2,4-dienylidene]-[4-[(R)-(4-methylphenyl)sulfinyl]phenyl]azanium bromide Traditional Name: (E)-[(2E,4E)-5-[4-[(R)-p-tolylsulfinyl]anilino]penta-2,4-dienylidene]-[4-[(R)-p-tolylsulfinyl]phenyl]ammonium bromide Formula: C31H29BrN2O2S2 MolecularWeight: 605.60816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C2=CC=C(C=C2)NC=CC=CC=[NH+]C3=CC=C(C=C3)S(=O)C4=CC=C(C=C4)C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)[S@@](=O)C2=CC=C(C=C2)N/C=C/C=C/C=[NH+]/C3=CC=C(C=C3)[S@](=O)C4=CC=C(C=C4)C.[Br-]

InChI

InChI=1S/C31H28N2O2S2.BrH/c1-24-6-14-28(15-7-24)36(34)30-18-10-26(11-19-30)32-22-4-3-5-23-33-27-12-20-31(21-13-27)37(35)29-16-8-25(2)9-17-29;/h3-23,32H,1-2H3;1H/b5-3+,22-4+,33-23+;/t36-,37-;/m1./s1