2-(3-cyanopropylsulfanyl)pyridine-3-carboxamide

Systemtic Name: 2-(3-cyanopropylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-(3-cyanopropylsulfanyl)pyridine-3-carboxamide CAS Name: 2-(3-cyanopropylthio)-3-pyridinecarboxamide IUPAC Name: 2-(3-cyanopropylsulfanyl)pyridine-3-carboxamide Traditional Name: 2-(3-cyanopropylthio)nicotinamide Formula: C10H11N3OS MolecularWeight: 221.27884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCCCC#N)C(=O)N

Isomeric SMILES

C1=CC(=C(N=C1)SCCCC#N)C(=O)N

InChI

InChI=1S/C10H11N3OS/c11-5-1-2-7-15-10-8(9(12)14)4-3-6-13-10/h3-4,6H,1-2,7H2,(H2,12,14)