2-(6-azanyl-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N,N-bis(2-methylpropyl)ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N,N-bis(2-methylpropyl)ethanamide Openeye Name: 2-(6-amino-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N,N-diisobutyl-acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridin-1-iumyl)thio]-N,N-bis(2-methylpropyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-1-ium-2-yl)sulfanyl-N,N-bis(2-methylpropyl)acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-pyridin-1-ium-2-yl)thio]-N,N-diisobutyl-acetamide Formula: C17H24N5OS+ MolecularWeight: 346.47036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)CSC1=C(C=C(C(=[NH+]1)N)C#N)C#N

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)CSC1=C(C=C(C(=[NH+]1)N)C#N)C#N

InChI

InChI=1S/C17H23N5OS/c1-11(2)8-22(9-12(3)4)15(23)10-24-17-14(7-19)5-13(6-18)16(20)21-17/h5,11-12H,8-10H2,1-4H3,(H2,20,21)/p+1