[2-(1,3-benzothiazol-2-yl)-4-ethylimino-cyclohexa-1,5-dien-1-yl] hydrogen sulfate

Systemtic Name: [2-(1,3-benzothiazol-2-yl)-4-ethylimino-cyclohexa-1,5-dien-1-yl] hydrogen sulfate Openeye Name: [2-(1,3-benzothiazol-2-yl)-4-ethylimino-cyclohexa-1,5-dien-1-yl] hydrogen sulfate CAS Name: sulfuric acid [2-(1,3-benzothiazol-2-yl)-4-ethylimino-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-yl)-4-ethyliminocyclohexa-1,5-dien-1-yl] hydrogen sulfate Traditional Name: sulfuric acid [2-(1,3-benzothiazol-2-yl)-4-ethylimino-cyclohexa-1,5-dien-1-yl] ester Formula: C15H14N2O4S2 MolecularWeight: 350.41266

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1CC(=C(C=C1)OS(=O)(=O)O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCN=C1CC(=C(C=C1)OS(=O)(=O)O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H14N2O4S2/c1-2-16-10-7-8-13(21-23(18,19)20)11(9-10)15-17-12-5-3-4-6-14(12)22-15/h3-8H,2,9H2,1H3,(H,18,19,20)