(2E)-2-[(2Z)-2-[2-chloranyl-3-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1-ethyl-benzo[e][1,3]benzothiazole

Systemtic Name: (2E)-2-[(2Z)-2-[2-chloranyl-3-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1-ethyl-benzo[e][1,3]benzothiazole Openeye Name: (2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)vinyl]cyclohex-2-en-1-ylidene]ethylidene]-1-ethyl-benzo[e][1,3]benzothiazole CAS Name: (2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-(1-ethyl-2-benzo[e][1,3]benzothiazol-1-iumyl)ethenyl]-1-cyclohex-2-enylidene]ethylidene]-1-ethylbenzo[e][1,3]benzothiazole IUPAC Name: (2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1-ethylbenzo[e][1,3]benzothiazole Traditional Name: (2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)vinyl]cyclohex-2-en-1-ylidene]ethylidene]-1-ethyl-benzo[e][1,3]benzothiazole Formula: C36H32ClN2S2+ MolecularWeight: 592.23568

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C2CCCC(=C2Cl)C=CC3=[N+](C4=C(S3)C=CC5=CC=CC=C54)CC)SC6=C1C7=CC=CC=C7C=C6

Isomeric SMILES

CCN1/C(=C\C=C/2\CCCC(=C2Cl)/C=C/C3=[N+](C4=C(S3)C=CC5=CC=CC=C54)CC)/SC6=C1C7=CC=CC=C7C=C6

InChI

InChI=1S/C36H32ClN2S2/c1-3-38-32(40-30-20-16-24-10-5-7-14-28(24)35(30)38)22-18-26-12-9-13-27(34(26)37)19-23-33-39(4-2)36-29-15-8-6-11-25(29)17-21-31(36)41-33/h5-8,10-11,14-23H,3-4,9,12-13H2,1-2H3/q+1