dimethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[propylamino(sulfanylidene)methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(propylthiocarbamoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCNC(=S)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H18N2O4S/c1-4-5-15-14(21)16-11-7-9(12(17)19-2)6-10(8-11)13(18)20-3/h6-8H,4-5H2,1-3H3,(H2,15,16,21)