3-chloranyl-5-methyl-2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)benzoic acid

Systemtic Name: 3-chloranyl-5-methyl-2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)benzoic acid Openeye Name: 3-chloro-2-(4-isopropyl-4-methyl-5-thioxo-1H-imidazol-2-yl)-5-methyl-benzoic acid CAS Name: 3-chloro-5-methyl-2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)benzoic acid IUPAC Name: 3-chloro-5-methyl-2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)benzoic acid Traditional Name: 3-chloro-2-(4-isopropyl-4-methyl-5-thioxo-2-imidazolin-2-yl)-5-methyl-benzoic acid Formula: C15H17ClN2O2S MolecularWeight: 324.82568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)C2=NC(C(=S)N2)(C)C(C)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)C2=NC(C(=S)N2)(C)C(C)C)Cl

InChI

InChI=1S/C15H17ClN2O2S/c1-7(2)15(4)14(21)17-12(18-15)11-9(13(19)20)5-8(3)6-10(11)16/h5-7H,1-4H3,(H,19,20)(H,17,18,21)