3-ethylsulfanyl-1-pyrazin-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-ethylsulfanyl-1-pyrazin-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-ethylsulfanyl-1-(pyrazine-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(ethylthio)-1-[oxo(2-pyrazinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-ethylsulfanyl-1-(pyrazine-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(ethylthio)-1-pyrazinoyl-proline Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CCN(C1C(=O)O)C(=O)C2=NC=CN=C2

Isomeric SMILES

CCSC1CCN(C1C(=O)O)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C12H15N3O3S/c1-2-19-9-3-6-15(10(9)12(17)18)11(16)8-7-13-4-5-14-8/h4-5,7,9-10H,2-3,6H2,1H3,(H,17,18)