ethyl 2-[4-(4-methylphenoxy)butanoylcarbamothioylamino]benzoate

Systemtic Name: ethyl 2-[4-(4-methylphenoxy)butanoylcarbamothioylamino]benzoate Openeye Name: ethyl 2-[4-(4-methylphenoxy)butanoylcarbamothioylamino]benzoate CAS Name: 2-[[[[4-(4-methylphenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-methylphenoxy)butanoylcarbamothioylamino]benzoate Traditional Name: 2-[4-(4-methylphenoxy)butanoylthiocarbamoylamino]benzoic acid ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=S)NC(=O)CCCOC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=S)NC(=O)CCCOC2=CC=C(C=C2)C

InChI

InChI=1S/C21H24N2O4S/c1-3-26-20(25)17-7-4-5-8-18(17)22-21(28)23-19(24)9-6-14-27-16-12-10-15(2)11-13-16/h4-5,7-8,10-13H,3,6,9,14H2,1-2H3,(H2,22,23,24,28)