3-methyl-2-(phenylcarbamoylamino)-3-sulfanyl-butanoic acid

Systemtic Name: 3-methyl-2-(phenylcarbamoylamino)-3-sulfanyl-butanoic acid Openeye Name: 3-methyl-2-(phenylcarbamoylamino)-3-sulfanyl-butanoic acid CAS Name: 2-[[anilino(oxo)methyl]amino]-3-mercapto-3-methylbutanoic acid IUPAC Name: 3-methyl-2-(phenylcarbamoylamino)-3-sulfanylbutanoic acid Traditional Name: 3-mercapto-3-methyl-2-(phenylcarbamoylamino)butyric acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)O)NC(=O)NC1=CC=CC=C1)S

Isomeric SMILES

CC(C)(C(C(=O)O)NC(=O)NC1=CC=CC=C1)S

InChI

InChI=1S/C12H16N2O3S/c1-12(2,18)9(10(15)16)14-11(17)13-8-6-4-3-5-7-8/h3-7,9,18H,1-2H3,(H,15,16)(H2,13,14,17)