5-butyl-6-propylsulfanyl-pyrazine-2-carboxamide

Systemtic Name: 5-butyl-6-propylsulfanyl-pyrazine-2-carboxamide Openeye Name: 5-butyl-6-propylsulfanyl-pyrazine-2-carboxamide CAS Name: 5-butyl-6-(propylthio)-2-pyrazinecarboxamide IUPAC Name: 5-butyl-6-propylsulfanylpyrazine-2-carboxamide Traditional Name: 5-butyl-6-(propylthio)pyrazinamide Formula: C12H19N3OS MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N=C1SCCC)C(=O)N

Isomeric SMILES

CCCCC1=NC=C(N=C1SCCC)C(=O)N

InChI

InChI=1S/C12H19N3OS/c1-3-5-6-9-12(17-7-4-2)15-10(8-14-9)11(13)16/h8H,3-7H2,1-2H3,(H2,13,16)