dipropan-2-yl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate

Systemtic Name: dipropan-2-yl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: diisopropyl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[(cyclopentylamino)-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 5-(cyclopentylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(cyclopentylthiocarbamoylamino)benzene-1,3-dicarboxylic acid diisopropyl ester Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=CC(=C1)NC(=S)NC2CCCC2)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C1=CC(=CC(=C1)NC(=S)NC2CCCC2)C(=O)OC(C)C

InChI

InChI=1S/C20H28N2O4S/c1-12(2)25-18(23)14-9-15(19(24)26-13(3)4)11-17(10-14)22-20(27)21-16-7-5-6-8-16/h9-13,16H,5-8H2,1-4H3,(H2,21,22,27)