ethyl (4Z,6Z)-5-butyl-1,2-dihydro-3-benzothionine-4-carboxylate

Systemtic Name: ethyl (4Z,6Z)-5-butyl-1,2-dihydro-3-benzothionine-4-carboxylate Openeye Name: ethyl (4Z,6Z)-5-butyl-1,2-dihydro-3-benzothionine-4-carboxylate CAS Name: (4Z,6Z)-5-butyl-1,2-dihydro-3-benzothionin-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4Z,6Z)-5-butyl-1,2-dihydro-3-benzothionine-4-carboxylate Traditional Name: (4Z,6Z)-5-butyl-1,2-dihydro-3-benzothionin-4-carboxylic acid ethyl ester Formula: C19H24O2S MolecularWeight: 316.45766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SCCC2=CC=CC=C2C=C1)C(=O)OCC

Isomeric SMILES

CCCC/C/1=C(/SCCC2=CC=CC=C2/C=C1)\C(=O)OCC

InChI

InChI=1S/C19H24O2S/c1-3-5-8-17-12-11-15-9-6-7-10-16(15)13-14-22-18(17)19(20)21-4-2/h6-7,9-12H,3-5,8,13-14H2,1-2H3/b12-11-,18-17-