S-(aminomethyl) 5-butylpyridine-2-carbothioate

Systemtic Name: S-(aminomethyl) 5-butylpyridine-2-carbothioate Openeye Name: S-(aminomethyl) 5-butylpyridine-2-carbothioate CAS Name: 5-butyl-2-pyridinecarbothioic acid S-(aminomethyl) ester IUPAC Name: S-(aminomethyl) 5-butylpyridine-2-carbothioate Traditional Name: 5-butylpyridine-2-carbothioic acid S-(aminomethyl) ester Formula: C11H16N2OS MolecularWeight: 224.32254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1)C(=O)SCN

Isomeric SMILES

CCCCC1=CN=C(C=C1)C(=O)SCN

InChI

InChI=1S/C11H16N2OS/c1-2-3-4-9-5-6-10(13-7-9)11(14)15-8-12/h5-7H,2-4,8,12H2,1H3