2-[(3-ethyl-4,5-diphenyl-1,3-thiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(1-ethyl-3-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)-4-oxidanyl-1,3-thiazol-5-yl]methylidene]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one

Systemtic Name: 2-[(3-ethyl-4,5-diphenyl-1,3-thiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(1-ethyl-3-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)-4-oxidanyl-1,3-thiazol-5-yl]methylidene]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one Openeye Name: 3-allyl-2-[(3-ethyl-4,5-diphenyl-thiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(1-ethyl-3-methyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)-4-hydroxy-thiazol-5-yl]methylene]thiazol-3-ium-4-one CAS Name: 2-[(3-ethyl-4,5-diphenyl-2-thiazolylidene)methyl]-5-[[3-ethyl-2-(1-ethyl-3-methyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)-4-hydroxy-5-thiazolyl]methylidene]-3-prop-2-enyl-4-thiazol-3-iumone IUPAC Name: 2-[(3-ethyl-4,5-diphenyl-1,3-thiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(1-ethyl-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)-4-hydroxy-1,3-thiazol-5-yl]methylidene]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one Traditional Name: 3-allyl-2-[(3-ethyl-4,5-diphenyl-4-thiazolin-2-ylidene)methyl]-5-[[3-ethyl-2-(1-ethyl-5-keto-3-methyl-2-thioxo-imidazolidin-4-ylidene)-4-hydroxy-4-thiazolin-5-yl]methylene]-2-thiazolin-3-ium-4-one Formula: C36H36N5O3S4+ MolecularWeight: 714.96274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=[N+](C(=O)C(=CC3=C(N(C(=C4C(=O)N(C(=S)N4C)CC)S3)CC)O)S2)CC=C)SC(=C1C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCN1C(=CC2=[N+](C(=O)C(=CC3=C(N(C(=C4C(=O)N(C(=S)N4C)CC)S3)CC)O)S2)CC=C)SC(=C1C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C36H35N5O3S4/c1-6-20-41-28(22-27-38(7-2)29(23-16-12-10-13-17-23)31(48-27)24-18-14-11-15-19-24)46-25(33(41)43)21-26-32(42)39(8-3)35(47-26)30-34(44)40(9-4)36(45)37(30)5/h6,10-19,21-22H,1,7-9,20H2,2-5H3/p+1