ethyl 4-[[4-(2-methoxyethoxy)-4-oxidanylidene-butanoyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[4-(2-methoxyethoxy)-4-oxidanylidene-butanoyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[4-(2-methoxyethoxy)-4-oxo-butanoyl]carbamothioylamino]benzoate CAS Name: 4-[[[[4-(2-methoxyethoxy)-1,4-dioxobutyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(2-methoxyethoxy)-4-oxobutanoyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-keto-4-(2-methoxyethoxy)butanoyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C17H22N2O6S/c1-3-24-16(22)12-4-6-13(7-5-12)18-17(26)19-14(20)8-9-15(21)25-11-10-23-2/h4-7H,3,8-11H2,1-2H3,(H2,18,19,20,26)