ethyl 3-(pentanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-(pentanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-(pentanoylamino)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 3-(1-oxopentylamino)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(pentanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 3-(valerylamino)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid ethyl ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(SC2=C1CCCC2)C(=O)OCC

Isomeric SMILES

CCCCC(=O)NC1=C(SC2=C1CCCC2)C(=O)OCC

InChI

InChI=1S/C16H23NO3S/c1-3-5-10-13(18)17-14-11-8-6-7-9-12(11)21-15(14)16(19)20-4-2/h3-10H2,1-2H3,(H,17,18)