3-(2-chlorophenyl)-5-methyl-2-propylsulfanyl-imidazole-4-carboxylic acid

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-2-propylsulfanyl-imidazole-4-carboxylic acid Openeye Name: 3-(2-chlorophenyl)-5-methyl-2-propylsulfanyl-imidazole-4-carboxylic acid CAS Name: 3-(2-chlorophenyl)-5-methyl-2-(propylthio)-4-imidazolecarboxylic acid IUPAC Name: 3-(2-chlorophenyl)-5-methyl-2-propylsulfanylimidazole-4-carboxylic acid Traditional Name: 3-(2-chlorophenyl)-5-methyl-2-(propylthio)imidazole-4-carboxylic acid Formula: C14H15ClN2O2S MolecularWeight: 310.7991

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(N1C2=CC=CC=C2Cl)C(=O)O)C

Isomeric SMILES

CCCSC1=NC(=C(N1C2=CC=CC=C2Cl)C(=O)O)C

InChI

InChI=1S/C14H15ClN2O2S/c1-3-8-20-14-16-9(2)12(13(18)19)17(14)11-7-5-4-6-10(11)15/h4-7H,3,8H2,1-2H3,(H,18,19)