methyl 2-[[4-(2-methoxyethoxy)-4-oxidanylidene-butanoyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-(2-methoxyethoxy)-4-oxidanylidene-butanoyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[4-(2-methoxyethoxy)-4-oxo-butanoyl]carbamothioylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[[4-(2-methoxyethoxy)-1,4-dioxobutyl]amino]-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(2-methoxyethoxy)-4-oxobutanoyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-keto-4-(2-methoxyethoxy)butanoyl]thiocarbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C18H24N2O6S2 MolecularWeight: 428.52296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CCC(=O)NC(=S)NC1=C(C2=C(S1)CCCC2)C(=O)OC

Isomeric SMILES

COCCOC(=O)CCC(=O)NC(=S)NC1=C(C2=C(S1)CCCC2)C(=O)OC

InChI

InChI=1S/C18H24N2O6S2/c1-24-9-10-26-14(22)8-7-13(21)19-18(27)20-16-15(17(23)25-2)11-5-3-4-6-12(11)28-16/h3-10H2,1-2H3,(H2,19,20,21,27)