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

Systemtic Name: diethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: diethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[propylamino(sulfanylidene)methyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(propylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(propylthiocarbamoylamino)benzene-1,3-dicarboxylic acid diethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4S/c1-4-7-17-16(23)18-13-9-11(14(19)21-5-2)8-12(10-13)15(20)22-6-3/h8-10H,4-7H2,1-3H3,(H2,17,18,23)