5-(cyclohexen-1-yl)-1-(2-methylpropyl)-2-methylsulfanyl-imidazole-4-carboxylic acid

Systemtic Name: 5-(cyclohexen-1-yl)-1-(2-methylpropyl)-2-methylsulfanyl-imidazole-4-carboxylic acid Openeye Name: 5-(cyclohexen-1-yl)-1-isobutyl-2-methylsulfanyl-imidazole-4-carboxylic acid CAS Name: 5-(1-cyclohexenyl)-1-(2-methylpropyl)-2-(methylthio)-4-imidazolecarboxylic acid IUPAC Name: 5-(cyclohexen-1-yl)-1-(2-methylpropyl)-2-methylsulfanylimidazole-4-carboxylic acid Traditional Name: 5-(cyclohexen-1-yl)-1-isobutyl-2-(methylthio)imidazole-4-carboxylic acid Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(N=C1SC)C(=O)O)C2=CCCCC2

Isomeric SMILES

CC(C)CN1C(=C(N=C1SC)C(=O)O)C2=CCCCC2

InChI

InChI=1S/C15H22N2O2S/c1-10(2)9-17-13(11-7-5-4-6-8-11)12(14(18)19)16-15(17)20-3/h7,10H,4-6,8-9H2,1-3H3,(H,18,19)