2-methyl-2-(oxidanidylmethyl)-4-pyrazin-2-yl-4-sulfanyl-butanoate

Systemtic Name: 2-methyl-2-(oxidanidylmethyl)-4-pyrazin-2-yl-4-sulfanyl-butanoate Openeye Name: 2-methyl-2-(oxidomethyl)-4-pyrazin-2-yl-4-sulfanyl-butanoate CAS Name: 4-mercapto-2-methyl-2-(oxidomethyl)-4-(2-pyrazinyl)butanoate IUPAC Name: 2-methyl-2-(oxidomethyl)-4-pyrazin-2-yl-4-sulfanylbutanoate Traditional Name: 4-mercapto-2-methyl-2-(oxidomethyl)-4-pyrazin-2-yl-butyrate Formula: C10H12N2O3S-2 MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=NC=CN=C1)S)(C[O-])C(=O)[O-]

Isomeric SMILES

CC(CC(C1=NC=CN=C1)S)(C[O-])C(=O)[O-]

InChI

InChI=1S/C10H13N2O3S/c1-10(6-13,9(14)15)4-8(16)7-5-11-2-3-12-7/h2-3,5,8,16H,4,6H2,1H3,(H,14,15)/q-1/p-1