2-[2-(4-methyl-2-oxidanylidene-3-propyl-imidazol-1-yl)phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(4-methyl-2-oxidanylidene-3-propyl-imidazol-1-yl)phenyl]sulfanylethanoic acid Openeye Name: 2-[2-(4-methyl-2-oxo-3-propyl-imidazol-1-yl)phenyl]sulfanylacetic acid CAS Name: 2-[[2-(4-methyl-2-oxo-3-propyl-1-imidazolyl)phenyl]thio]acetic acid IUPAC Name: 2-[2-(4-methyl-2-oxo-3-propylimidazol-1-yl)phenyl]sulfanylacetic acid Traditional Name: 2-[[2-(2-keto-4-methyl-3-propyl-4-imidazolin-1-yl)phenyl]thio]acetic acid Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CN(C1=O)C2=CC=CC=C2SCC(=O)O)C

Isomeric SMILES

CCCN1C(=CN(C1=O)C2=CC=CC=C2SCC(=O)O)C

InChI

InChI=1S/C15H18N2O3S/c1-3-8-16-11(2)9-17(15(16)20)12-6-4-5-7-13(12)21-10-14(18)19/h4-7,9H,3,8,10H2,1-2H3,(H,18,19)