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

Systemtic Name: (3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)methyl-[(4-methoxyphenyl)methyl]-methyl-azanium Openeye Name: (3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl-[(4-methoxyphenyl)methyl]-methyl-ammonium CAS Name: (3-cyano-4,6-dimethyl-2-sulfanylidene-1-pyridinyl)methyl-[(4-methoxyphenyl)methyl]-methylammonium IUPAC Name: (3-cyano-4,6-dimethyl-2-sulfanylidenepyridin-1-yl)methyl-[(4-methoxyphenyl)methyl]-methylazanium Traditional Name: (3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl-methyl-p-anisyl-ammonium Formula: C18H22N3OS+ MolecularWeight: 328.45178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3OS/c1-13-9-14(2)21(18(23)17(13)10-19)12-20(3)11-15-5-7-16(22-4)8-6-15/h5-9H,11-12H2,1-4H3/p+1