ethyl 4-(1,3-dithian-2-yl)-4H-pyridine-1-carboxylate

Systemtic Name: ethyl 4-(1,3-dithian-2-yl)-4H-pyridine-1-carboxylate Openeye Name: ethyl 4-(1,3-dithian-2-yl)-4H-pyridine-1-carboxylate CAS Name: 4-(1,3-dithian-2-yl)-4H-pyridine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-dithian-2-yl)-4H-pyridine-1-carboxylate Traditional Name: 4-(1,3-dithian-2-yl)-4H-pyridine-1-carboxylic acid ethyl ester Formula: C12H17NO2S2 MolecularWeight: 271.39888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CC(C=C1)C2SCCCS2

Isomeric SMILES

CCOC(=O)N1C=CC(C=C1)C2SCCCS2

InChI

InChI=1S/C12H17NO2S2/c1-2-15-12(14)13-6-4-10(5-7-13)11-16-8-3-9-17-11/h4-7,10-11H,2-3,8-9H2,1H3