2-[3-[(2,3-dimethylphenyl)amino]-5-methyl-phenyl]sulfanylethanoic acid

Systemtic Name: 2-[3-[(2,3-dimethylphenyl)amino]-5-methyl-phenyl]sulfanylethanoic acid Openeye Name: 2-[3-(2,3-dimethylanilino)-5-methyl-phenyl]sulfanylacetic acid CAS Name: 2-[[3-(2,3-dimethylanilino)-5-methylphenyl]thio]acetic acid IUPAC Name: 2-[3-(2,3-dimethylanilino)-5-methylphenyl]sulfanylacetic acid Traditional Name: 2-[[3-(2,3-dimethylanilino)-5-methyl-phenyl]thio]acetic acid Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=CC(=CC(=C2)C)SCC(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=CC(=CC(=C2)C)SCC(=O)O)C

InChI

InChI=1S/C17H19NO2S/c1-11-7-14(9-15(8-11)21-10-17(19)20)18-16-6-4-5-12(2)13(16)3/h4-9,18H,10H2,1-3H3,(H,19,20)