3-methyl-2-(pyrazin-2-ylcarbonylamino)-3-sulfanyl-butanoic acid

Systemtic Name: 3-methyl-2-(pyrazin-2-ylcarbonylamino)-3-sulfanyl-butanoic acid Openeye Name: 3-methyl-2-(pyrazine-2-carbonylamino)-3-sulfanyl-butanoic acid CAS Name: 3-mercapto-3-methyl-2-[[oxo(2-pyrazinyl)methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-(pyrazine-2-carbonylamino)-3-sulfanylbutanoic acid Traditional Name: 3-mercapto-3-methyl-2-(pyrazinoylamino)butyric acid Formula: C10H13N3O3S MolecularWeight: 255.29352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O3S/c1-10(2,17)7(9(15)16)13-8(14)6-5-11-3-4-12-6/h3-5,7,17H,1-2H3,(H,13,14)(H,15,16)