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

Systemtic Name: ethyl 2-[[4-(2-methoxyethoxy)-4-oxidanylidene-butanoyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C19H26N2O6S2 MolecularWeight: 442.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C19H26N2O6S2/c1-3-26-18(24)16-12-6-4-5-7-13(12)29-17(16)21-19(28)20-14(22)8-9-15(23)27-11-10-25-2/h3-11H2,1-2H3,(H2,20,21,22,28)