6-butylsulfanyl-5-propyl-pyrazine-2-carbothioamide

Systemtic Name: 6-butylsulfanyl-5-propyl-pyrazine-2-carbothioamide Openeye Name: 6-butylsulfanyl-5-propyl-pyrazine-2-carbothioamide CAS Name: 6-(butylthio)-5-propyl-2-pyrazinecarbothioamide IUPAC Name: 6-butylsulfanyl-5-propylpyrazine-2-carbothioamide Traditional Name: 6-(butylthio)-5-propyl-thiopyrazinamide Formula: C12H19N3S2 MolecularWeight: 269.42936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=CN=C1CCC)C(=S)N

Isomeric SMILES

CCCCSC1=NC(=CN=C1CCC)C(=S)N

InChI

InChI=1S/C12H19N3S2/c1-3-5-7-17-12-9(6-4-2)14-8-10(15-12)11(13)16/h8H,3-7H2,1-2H3,(H2,13,16)