2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-2-yl)sulfanyl]ethanamide

Systemtic Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-2-yl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-2-yl)thio]acetamide IUPAC Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-2-yl)sulfanyl]acetamide Traditional Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-2-yl)thio]acetamide Formula: C12H16N4OS+2 MolecularWeight: 264.34664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C=C(C(=[NH+]2)SCC(=O)N)C#N

Isomeric SMILES

C[NH+]1CCC2=C(C1)C=C(C(=[NH+]2)SCC(=O)N)C#N

InChI

InChI=1S/C12H14N4OS/c1-16-3-2-10-9(6-16)4-8(5-13)12(15-10)18-7-11(14)17/h4H,2-3,6-7H2,1H3,(H2,14,17)/p+2