methyl 4-(morpholin-4-ylcarbonylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(morpholin-4-ylcarbonylcarbamothioylamino)benzoate Openeye Name: methyl 4-(morpholine-4-carbonylcarbamothioylamino)benzoate CAS Name: 4-[[[[4-morpholinyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(morpholine-4-carbonylcarbamothioylamino)benzoate Traditional Name: 4-(morpholine-4-carbonylthiocarbamoylamino)benzoic acid methyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4S/c1-20-12(18)10-2-4-11(5-3-10)15-13(22)16-14(19)17-6-8-21-9-7-17/h2-5H,6-9H2,1H3,(H2,15,16,19,22)