3-azanyl-6-chloranyl-5-propan-2-ylsulfanyl-pyrazine-2-carboxylic acid

Systemtic Name: 3-azanyl-6-chloranyl-5-propan-2-ylsulfanyl-pyrazine-2-carboxylic acid Openeye Name: 3-amino-6-chloro-5-isopropylsulfanyl-pyrazine-2-carboxylic acid CAS Name: 3-amino-6-chloro-5-(propan-2-ylthio)-2-pyrazinecarboxylic acid IUPAC Name: 3-amino-6-chloro-5-propan-2-ylsulfanylpyrazine-2-carboxylic acid Traditional Name: 3-amino-6-chloro-5-(isopropylthio)pyrazinoic acid Formula: C8H10ClN3O2S MolecularWeight: 247.7019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=C(N=C1Cl)C(=O)O)N

Isomeric SMILES

CC(C)SC1=NC(=C(N=C1Cl)C(=O)O)N

InChI

InChI=1S/C8H10ClN3O2S/c1-3(2)15-7-5(9)11-4(8(13)14)6(10)12-7/h3H,1-2H3,(H2,10,12)(H,13,14)