(3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: (3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: (3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: (3-cyano-4,6-dimethyl-2-sulfanylidene-1-pyridinyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: (3-cyano-4,6-dimethyl-2-sulfanylidenepyridin-1-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: (3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C19H23N4OS+ MolecularWeight: 355.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1C[NH+](C)CC2=CC=C(C=C2)C(=O)NC)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=S)N1C[NH+](C)CC2=CC=C(C=C2)C(=O)NC)C#N)C

InChI

InChI=1S/C19H22N4OS/c1-13-9-14(2)23(19(25)17(13)10-20)12-22(4)11-15-5-7-16(8-6-15)18(24)21-3/h5-9H,11-12H2,1-4H3,(H,21,24)/p+1