ethyl 2-(1,3-benzothiazol-2-yl)-2-(3-methyl-2H-1,2,3-thiadiazol-3-ium-5-ylidene)ethanoate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-yl)-2-(3-methyl-2H-1,2,3-thiadiazol-3-ium-5-ylidene)ethanoate Openeye Name: ethyl 2-(1,3-benzothiazol-2-yl)-2-(3-methyl-2H-thiadiazol-3-ium-5-ylidene)acetate CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(3-methyl-2H-thiadiazol-3-ium-5-ylidene)acetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-yl)-2-(3-methyl-2H-thiadiazol-3-ium-5-ylidene)acetate Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(3-methyl-2H-thiadiazol-3-ium-5-ylidene)acetic acid ethyl ester Formula: C14H14N3O2S2+ MolecularWeight: 320.40986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C=[N+](NS1)C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C(=C1C=[N+](NS1)C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H13N3O2S2/c1-3-19-14(18)12(11-8-17(2)16-21-11)13-15-9-6-4-5-7-10(9)20-13/h4-8H,3H2,1-2H3/p+1