(5Z)-3-ethyl-2-[(Z)-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)methyl]-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)ethylidene]-1,3-thiazol-3-ium-4-one

Systemtic Name: (5Z)-3-ethyl-2-[(Z)-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)methyl]-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)ethylidene]-1,3-thiazol-3-ium-4-one Openeye Name: (5Z)-3-ethyl-2-[(Z)-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)methyl]-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)ethylidene]thiazol-3-ium-4-one CAS Name: (5Z)-3-ethyl-2-[(Z)-(1-ethyl-2-benzo[e][1,3]benzothiazolylidene)methyl]-5-[(2Z)-2-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)ethylidene]-4-thiazol-3-iumone IUPAC Name: (5Z)-3-ethyl-2-[(Z)-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)methyl]-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)ethylidene]-1,3-thiazol-3-ium-4-one Traditional Name: (5Z)-3-ethyl-2-[(Z)-(1-ethylbenzo[e][1,3]benzothiazol-2-ylidene)methyl]-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)ethylidene]-2-thiazolin-3-ium-4-one Formula: C33H28N3OS3+ MolecularWeight: 578.78992

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=[N+](C(=O)C(=CC=C3N(C4=C(S3)C=CC5=CC=CC=C54)C)S2)CC)SC6=C1C7=CC=CC=C7C=C6

Isomeric SMILES

CCN1/C(=C/C2=[N+](C(=O)/C(=C/C=C\3/N(C4=C(S3)C=CC5=CC=CC=C54)C)/S2)CC)/SC6=C1C7=CC=CC=C7C=C6

InChI

InChI=1S/C33H28N3OS3/c1-4-35-29(39-26-17-15-22-11-7-9-13-24(22)32(26)35)20-30-36(5-2)33(37)27(40-30)18-19-28-34(3)31-23-12-8-6-10-21(23)14-16-25(31)38-28/h6-20H,4-5H2,1-3H3/q+1/b27-18-,28-19-