2-[1-(4-chlorophenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoic acid hydrate

Systemtic Name: 2-[1-(4-chlorophenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoic acid hydrate Openeye Name: 2-[1-(4-chlorophenyl)-5-oxo-2-thioxo-imidazolidin-4-yl]acetic acid hydrate CAS Name: 2-[1-(4-chlorophenyl)-5-oxo-2-sulfanylidene-4-imidazolidinyl]acetic acid hydrate IUPAC Name: 2-[1-(4-chlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid hydrate Traditional Name: 2-[1-(4-chlorophenyl)-5-keto-2-thioxo-imidazolidin-4-yl]acetic acid hydrate Formula: C11H11ClN2O4S MolecularWeight: 302.73404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(NC2=S)CC(=O)O)Cl.O

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C(NC2=S)CC(=O)O)Cl.O

InChI

InChI=1S/C11H9ClN2O3S.H2O/c12-6-1-3-7(4-2-6)14-10(17)8(5-9(15)16)13-11(14)18;/h1-4,8H,5H2,(H,13,18)(H,15,16);1H2