1-methylsulfanyl-3-[(4-phenylphenyl)methyl]-2-propyl-2H-imidazole-4-carboxylic acid

Systemtic Name: 1-methylsulfanyl-3-[(4-phenylphenyl)methyl]-2-propyl-2H-imidazole-4-carboxylic acid Openeye Name: 1-methylsulfanyl-3-[(4-phenylphenyl)methyl]-2-propyl-2H-imidazole-4-carboxylic acid CAS Name: 1-(methylthio)-3-[(4-phenylphenyl)methyl]-2-propyl-2H-imidazole-4-carboxylic acid IUPAC Name: 1-methylsulfanyl-3-[(4-phenylphenyl)methyl]-2-propyl-2H-imidazole-4-carboxylic acid Traditional Name: 1-(methylthio)-3-(4-phenylbenzyl)-2-propyl-4-imidazoline-4-carboxylic acid Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1N(C=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)SC

Isomeric SMILES

CCCC1N(C=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)SC

InChI

InChI=1S/C21H24N2O2S/c1-3-7-20-22(19(21(24)25)15-23(20)26-2)14-16-10-12-18(13-11-16)17-8-5-4-6-9-17/h4-6,8-13,15,20H,3,7,14H2,1-2H3,(H,24,25)