ethyl 6-phenethyl-2,3-dihydro-1,4-dithiine-5-carboxylate

Systemtic Name: ethyl 6-phenethyl-2,3-dihydro-1,4-dithiine-5-carboxylate Openeye Name: ethyl 6-phenethyl-2,3-dihydro-1,4-dithiine-5-carboxylate CAS Name: 6-phenethyl-2,3-dihydro-1,4-dithiin-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-phenethyl-2,3-dihydro-1,4-dithiine-5-carboxylate Traditional Name: 6-phenethyl-2,3-dihydro-1,4-dithiin-5-carboxylic acid ethyl ester Formula: C15H18O2S2 MolecularWeight: 294.43222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SCCS1)CCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SCCS1)CCC2=CC=CC=C2

InChI

InChI=1S/C15H18O2S2/c1-2-17-15(16)14-13(18-10-11-19-14)9-8-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3