ethyl (6S)-2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl (6S)-2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl (6S)-2-[[2-(2-ethoxy-2-oxo-ethyl)sulfanylacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6S)-2-[[2-[(2-ethoxy-2-oxoethyl)thio]-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-2-[[2-(2-ethoxy-2-oxoethyl)sulfanylacetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6S)-2-[[2-[(2-ethoxy-2-keto-ethyl)thio]acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C18H25NO5S2 MolecularWeight: 399.5248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(C2=C(S1)C[C@H](CC2)C)C(=O)OCC

InChI

InChI=1S/C18H25NO5S2/c1-4-23-15(21)10-25-9-14(20)19-17-16(18(22)24-5-2)12-7-6-11(3)8-13(12)26-17/h11H,4-10H2,1-3H3,(H,19,20)/t11-/m0/s1