2-methyl-2-[[4-(methylsulfanylmethyl)phenyl]carbonylamino]pentanoic acid

Systemtic Name: 2-methyl-2-[[4-(methylsulfanylmethyl)phenyl]carbonylamino]pentanoic acid Openeye Name: 2-methyl-2-[[4-(methylsulfanylmethyl)benzoyl]amino]pentanoic acid CAS Name: 2-methyl-2-[[[4-[(methylthio)methyl]phenyl]-oxomethyl]amino]pentanoic acid IUPAC Name: 2-methyl-2-[[4-(methylsulfanylmethyl)benzoyl]amino]pentanoic acid Traditional Name: 2-methyl-2-[[4-[(methylthio)methyl]benzoyl]amino]valeric acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NC(=O)C1=CC=C(C=C1)CSC

Isomeric SMILES

CCCC(C)(C(=O)O)NC(=O)C1=CC=C(C=C1)CSC

InChI

InChI=1S/C15H21NO3S/c1-4-9-15(2,14(18)19)16-13(17)12-7-5-11(6-8-12)10-20-3/h5-8H,4,9-10H2,1-3H3,(H,16,17)(H,18,19)