3-ethyl-2-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-oxidanyl-1,3-thiazol-5-yl]methylidene]-1,3-thiazol-3-ium-4-one

Systemtic Name: 3-ethyl-2-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-oxidanyl-1,3-thiazol-5-yl]methylidene]-1,3-thiazol-3-ium-4-one Openeye Name: 3-ethyl-2-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-4-hydroxy-thiazol-5-yl]methylene]thiazol-3-ium-4-one CAS Name: 3-ethyl-2-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-4-hydroxy-5-thiazolyl]methylidene]-4-thiazol-3-iumone IUPAC Name: 3-ethyl-2-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-hydroxy-1,3-thiazol-5-yl]methylidene]-1,3-thiazol-3-ium-4-one Traditional Name: 3-ethyl-2-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5-[[3-ethyl-2-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)-4-hydroxy-4-thiazolin-5-yl]methylene]-2-thiazolin-3-ium-4-one Formula: C26H27N4O3S5+ MolecularWeight: 603.84258

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC3=[N+](C(=O)C(=CC4=C(N(C(=C5C(=O)N(C(=S)S5)CC)S4)CC)O)S3)CC

Isomeric SMILES

CCN1C2=CC=CC=C2SC1=CC3=[N+](C(=O)C(=CC4=C(N(C(=C5C(=O)N(C(=S)S5)CC)S4)CC)O)S3)CC

InChI

InChI=1S/C26H26N4O3S5/c1-5-27-15-11-9-10-12-16(15)35-19(27)14-20-28(6-2)22(31)17(36-20)13-18-23(32)29(7-3)25(37-18)21-24(33)30(8-4)26(34)38-21/h9-14H,5-8H2,1-4H3/p+1