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

Systemtic Name: 3-[(2-chlorophenyl)methyl]-5-methyl-2-propylsulfanyl-imidazole-4-carboxylic acid Openeye Name: 3-[(2-chlorophenyl)methyl]-5-methyl-2-propylsulfanyl-imidazole-4-carboxylic acid CAS Name: 3-[(2-chlorophenyl)methyl]-5-methyl-2-(propylthio)-4-imidazolecarboxylic acid IUPAC Name: 3-[(2-chlorophenyl)methyl]-5-methyl-2-propylsulfanylimidazole-4-carboxylic acid Traditional Name: 3-(2-chlorobenzyl)-5-methyl-2-(propylthio)imidazole-4-carboxylic acid Formula: C15H17ClN2O2S MolecularWeight: 324.82568

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(N1CC2=CC=CC=C2Cl)C(=O)O)C

Isomeric SMILES

CCCSC1=NC(=C(N1CC2=CC=CC=C2Cl)C(=O)O)C

InChI

InChI=1S/C15H17ClN2O2S/c1-3-8-21-15-17-10(2)13(14(19)20)18(15)9-11-6-4-5-7-12(11)16/h4-7H,3,8-9H2,1-2H3,(H,19,20)