(2E)-3-ethyl-2-[[(3Z)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-5-methyl-5-phenyl-cyclohexen-1-yl]methylidene]-5-thiophen-2-yl-1,3-benzothiazole

Systemtic Name: (2E)-3-ethyl-2-[[(3Z)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-5-methyl-5-phenyl-cyclohexen-1-yl]methylidene]-5-thiophen-2-yl-1,3-benzothiazole Openeye Name: (2E)-3-ethyl-2-[[(3Z)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylene]-5-methyl-5-phenyl-cyclohexen-1-yl]methylene]-5-(2-thienyl)-1,3-benzothiazole CAS Name: (2E)-3-ethyl-2-[[(3Z)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-5-methyl-5-phenyl-1-cyclohexenyl]methylidene]-5-thiophen-2-yl-1,3-benzothiazole IUPAC Name: (2E)-3-ethyl-2-[[(3Z)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-5-methyl-5-phenylcyclohexen-1-yl]methylidene]-5-thiophen-2-yl-1,3-benzothiazole Traditional Name: (2E)-3-ethyl-2-[[(3Z)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylene]-5-methyl-5-phenyl-cyclohexen-1-yl]methylene]-5-(2-thienyl)-1,3-benzothiazole Formula: C37H35N2S3+ MolecularWeight: 603.8822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C3=CC=CS3)SC1=CC4=CC(=CC5=[N+](C6=CC=CC=C6S5)CC)CC(C4)(C)C7=CC=CC=C7

Isomeric SMILES

CCN\1C2=C(C=CC(=C2)C3=CC=CS3)S/C1=C/C4=C/C(=C\C5=[N+](C6=CC=CC=C6S5)CC)/CC(C4)(C)C7=CC=CC=C7

InChI

InChI=1S/C37H35N2S3/c1-4-38-30-14-9-10-15-33(30)41-35(38)21-26-20-27(25-37(3,24-26)29-12-7-6-8-13-29)22-36-39(5-2)31-23-28(17-18-34(31)42-36)32-16-11-19-40-32/h6-23H,4-5,24-25H2,1-3H3/q+1