4-[(E)-[1-(4-chloranyl-2-methyl-phenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[1-(4-chloranyl-2-methyl-phenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[1-(4-chloro-2-methyl-phenyl)-5-oxo-2-thioxo-imidazolidin-4-ylidene]methyl]benzoic acid CAS Name: 4-[(E)-[1-(4-chloro-2-methylphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[1-(4-chloro-2-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[1-(4-chloro-2-methyl-phenyl)-5-keto-2-thioxo-imidazolidin-4-ylidene]methyl]benzoic acid Formula: C18H13ClN2O3S MolecularWeight: 372.82542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2C(=O)C(=CC3=CC=C(C=C3)C(=O)O)NC2=S

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2C(=O)/C(=C\C3=CC=C(C=C3)C(=O)O)/NC2=S

InChI

InChI=1S/C18H13ClN2O3S/c1-10-8-13(19)6-7-15(10)21-16(22)14(20-18(21)25)9-11-2-4-12(5-3-11)17(23)24/h2-9H,1H3,(H,20,25)(H,23,24)/b14-9+