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

Systemtic Name: diethyl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: diethyl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[(cyclopentylamino)-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(cyclopentylthiocarbamoylamino)benzene-1,3-dicarboxylic acid diethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2CCCC2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2CCCC2)C(=O)OCC

InChI

InChI=1S/C18H24N2O4S/c1-3-23-16(21)12-9-13(17(22)24-4-2)11-15(10-12)20-18(25)19-14-7-5-6-8-14/h9-11,14H,3-8H2,1-2H3,(H2,19,20,25)