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

Systemtic Name: diethyl 5-(cyclopropylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: diethyl 5-(cyclopropylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[(cyclopropylamino)-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(cyclopropylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(cyclopropylthiocarbamoylamino)benzene-1,3-dicarboxylic acid diethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2CC2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2CC2)C(=O)OCC

InChI

InChI=1S/C16H20N2O4S/c1-3-21-14(19)10-7-11(15(20)22-4-2)9-13(8-10)18-16(23)17-12-5-6-12/h7-9,12H,3-6H2,1-2H3,(H2,17,18,23)