2-azanyl-2-[4-(2,2-dimethylbutanoylamino)phenyl]sulfanyl-ethanoic acid

Systemtic Name: 2-azanyl-2-[4-(2,2-dimethylbutanoylamino)phenyl]sulfanyl-ethanoic acid Openeye Name: 2-amino-2-[4-(2,2-dimethylbutanoylamino)phenyl]sulfanyl-acetic acid CAS Name: 2-amino-2-[[4-[(2,2-dimethyl-1-oxobutyl)amino]phenyl]thio]acetic acid IUPAC Name: 2-amino-2-[4-(2,2-dimethylbutanoylamino)phenyl]sulfanylacetic acid Traditional Name: 2-amino-2-[[4-(2,2-dimethylbutanoylamino)phenyl]thio]acetic acid Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NC1=CC=C(C=C1)SC(C(=O)O)N

Isomeric SMILES

CCC(C)(C)C(=O)NC1=CC=C(C=C1)SC(C(=O)O)N

InChI

InChI=1S/C14H20N2O3S/c1-4-14(2,3)13(19)16-9-5-7-10(8-6-9)20-11(15)12(17)18/h5-8,11H,4,15H2,1-3H3,(H,16,19)(H,17,18)