5-propylpyridine-2-carbothioic S-acid

Systemtic Name: 5-propylpyridine-2-carbothioic S-acid Openeye Name: 5-propylpyridine-2-carbothioic S-acid CAS Name: 5-propyl-2-pyridinecarbothioic S-acid IUPAC Name: 5-propylpyridine-2-carbothioic S-acid Traditional Name: 5-propylthiopicolinic acid Formula: C9H11NOS MolecularWeight: 181.25474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN=C(C=C1)C(=O)S

Isomeric SMILES

CCCC1=CN=C(C=C1)C(=O)S

InChI

InChI=1S/C9H11NOS/c1-2-3-7-4-5-8(9(11)12)10-6-7/h4-6H,2-3H2,1H3,(H,11,12)