2-(3-azanylpyridin-4-yl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N,N-bis(2-cyanoethyl)acetamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N,N-bis(2-cyanoethyl)acetamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N,N-bis(2-cyanoethyl)acetamide Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC(=C1SCC(=O)N(CCC#N)CCC#N)N

Isomeric SMILES

C1=CN=CC(=C1SCC(=O)N(CCC#N)CCC#N)N

InChI

InChI=1S/C13H15N5OS/c14-4-1-7-18(8-2-5-15)13(19)10-20-12-3-6-17-9-11(12)16/h3,6,9H,1-2,7-8,10,16H2