ethyl 2-(1,3-dithian-2-ylidene)-2-imidazol-1-yl-ethanoate

Systemtic Name: ethyl 2-(1,3-dithian-2-ylidene)-2-imidazol-1-yl-ethanoate Openeye Name: ethyl 2-(1,3-dithian-2-ylidene)-2-imidazol-1-yl-acetate CAS Name: 2-(1,3-dithian-2-ylidene)-2-(1-imidazolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-dithian-2-ylidene)-2-imidazol-1-ylacetate Traditional Name: 2-(1,3-dithian-2-ylidene)-2-imidazol-1-yl-acetic acid ethyl ester Formula: C11H14N2O2S2 MolecularWeight: 270.37106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1SCCCS1)N2C=CN=C2

Isomeric SMILES

CCOC(=O)C(=C1SCCCS1)N2C=CN=C2

InChI

InChI=1S/C11H14N2O2S2/c1-2-15-10(14)9(13-5-4-12-8-13)11-16-6-3-7-17-11/h4-5,8H,2-3,6-7H2,1H3