4-(pyridin-3-ylmethylsulfanyl)pyridine-2-carbothioamide

Systemtic Name: 4-(pyridin-3-ylmethylsulfanyl)pyridine-2-carbothioamide Openeye Name: 4-(3-pyridylmethylsulfanyl)pyridine-2-carbothioamide CAS Name: 4-(3-pyridinylmethylthio)-2-pyridinecarbothioamide IUPAC Name: 4-(pyridin-3-ylmethylsulfanyl)pyridine-2-carbothioamide Traditional Name: 4-(3-pyridylmethylthio)thiopicolinamide Formula: C12H11N3S2 MolecularWeight: 261.36584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=CC(=NC=C2)C(=S)N

Isomeric SMILES

C1=CC(=CN=C1)CSC2=CC(=NC=C2)C(=S)N

InChI

InChI=1S/C12H11N3S2/c13-12(16)11-6-10(3-5-15-11)17-8-9-2-1-4-14-7-9/h1-7H,8H2,(H2,13,16)