[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: [2-(5-methyl-2-thienyl)-2-oxo-ethyl] 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [2-(5-methyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-methylthiophen-2-yl)-2-oxoethyl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid [2-keto-2-(5-methyl-2-thienyl)ethyl] ester Formula: C16H16O3S2 MolecularWeight: 320.42644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)COC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC1=CC=C(S1)C(=O)COC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C16H16O3S2/c1-10-6-7-14(20-10)12(17)9-19-16(18)15-8-11-4-2-3-5-13(11)21-15/h6-8H,2-5,9H2,1H3