2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(3,4-dimethylanilino)-2-oxo-1-phenyl-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(3,4-dimethylanilino)-2-oxo-1-phenylethyl]thio]acetic acid IUPAC Name: 2-[2-(3,4-dimethylanilino)-2-oxo-1-phenylethyl]sulfanylacetic acid Traditional Name: 2-[[2-(3,4-dimethylanilino)-2-keto-1-phenyl-ethyl]thio]acetic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO3S/c1-12-8-9-15(10-13(12)2)19-18(22)17(23-11-16(20)21)14-6-4-3-5-7-14/h3-10,17H,11H2,1-2H3,(H,19,22)(H,20,21)