2-[methanoyl-(2,4,6-trimethylphenyl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[methanoyl-(2,4,6-trimethylphenyl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-(N-formyl-2,4,6-trimethyl-anilino)-4-methylsulfanyl-butanoic acid CAS Name: 2-(N-formyl-2,4,6-trimethylanilino)-4-(methylthio)butanoic acid IUPAC Name: 2-(N-formyl-2,4,6-trimethylanilino)-4-methylsulfanylbutanoic acid Traditional Name: 2-(N-formyl-2,4,6-trimethyl-anilino)-4-(methylthio)butyric acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N(C=O)C(CCSC)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N(C=O)C(CCSC)C(=O)O)C

InChI

InChI=1S/C15H21NO3S/c1-10-7-11(2)14(12(3)8-10)16(9-17)13(15(18)19)5-6-20-4/h7-9,13H,5-6H2,1-4H3,(H,18,19)