methyl 3-(furan-2-ylcarbonylcarbamothioylamino)-4-morpholin-4-yl-benzoate

Systemtic Name: methyl 3-(furan-2-ylcarbonylcarbamothioylamino)-4-morpholin-4-yl-benzoate Openeye Name: methyl 3-(furan-2-carbonylcarbamothioylamino)-4-morpholino-benzoate CAS Name: 3-[[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-4-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 3-(furan-2-carbonylcarbamothioylamino)-4-morpholin-4-ylbenzoate Traditional Name: 3-(2-furoylthiocarbamoylamino)-4-morpholino-benzoic acid methyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=S)NC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=S)NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H19N3O5S/c1-24-17(23)12-4-5-14(21-6-9-25-10-7-21)13(11-12)19-18(27)20-16(22)15-3-2-8-26-15/h2-5,8,11H,6-7,9-10H2,1H3,(H2,19,20,22,27)