ethyl (6S)-2-[2-(3-cyclopentylpropanoyloxy)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl (6S)-2-[2-(3-cyclopentylpropanoyloxy)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl (6S)-2-[[2-(3-cyclopentylpropanoyloxy)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6S)-2-[[2-(3-cyclopentyl-1-oxopropoxy)-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-2-[[2-(3-cyclopentylpropanoyloxy)acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6S)-2-[[2-(3-cyclopentylpropanoyloxy)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C22H31NO5S MolecularWeight: 421.55024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)COC(=O)CCC3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC[C@@H](C2)C)NC(=O)COC(=O)CCC3CCCC3

InChI

InChI=1S/C22H31NO5S/c1-3-27-22(26)20-16-10-8-14(2)12-17(16)29-21(20)23-18(24)13-28-19(25)11-9-15-6-4-5-7-15/h14-15H,3-13H2,1-2H3,(H,23,24)/t14-/m0/s1