methyl 4,5-dimethoxy-2-(propylcarbamothioylamino)benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-(propylcarbamothioylamino)benzoate Openeye Name: methyl 4,5-dimethoxy-2-(propylcarbamothioylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[propylamino(sulfanylidene)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-(propylcarbamothioylamino)benzoate Traditional Name: 4,5-dimethoxy-2-(propylthiocarbamoylamino)benzoic acid methyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=CC(=C(C=C1C(=O)OC)OC)OC

Isomeric SMILES

CCCNC(=S)NC1=CC(=C(C=C1C(=O)OC)OC)OC

InChI

InChI=1S/C14H20N2O4S/c1-5-6-15-14(21)16-10-8-12(19-3)11(18-2)7-9(10)13(17)20-4/h7-8H,5-6H2,1-4H3,(H2,15,16,21)