2-azanyl-6-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-(2,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-4-ethyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(2,4-dimethylphenyl)-2-oxoethyl]thio]-4-ethylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-4-ethylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-(2,4-dimethylphenyl)-2-keto-ethyl]thio]-4-ethyl-pyridin-1-ium-3,5-dicarbonitrile Formula: C19H19N4OS+ MolecularWeight: 351.44536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=[NH+]C(=C1C#N)SCC(=O)C2=C(C=C(C=C2)C)C)N)C#N

Isomeric SMILES

CCC1=C(C(=[NH+]C(=C1C#N)SCC(=O)C2=C(C=C(C=C2)C)C)N)C#N

InChI

InChI=1S/C19H18N4OS/c1-4-13-15(8-20)18(22)23-19(16(13)9-21)25-10-17(24)14-6-5-11(2)7-12(14)3/h5-7H,4,10H2,1-3H3,(H2,22,23)/p+1