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

Systemtic Name: (5-cyano-3-ethoxycarbonyl-2-methyl-6-sulfanylidene-pyridin-1-yl)methyl-[(4-methoxyphenyl)methyl]-methyl-azanium Openeye Name: (5-cyano-3-ethoxycarbonyl-2-methyl-6-thioxo-1-pyridyl)methyl-[(4-methoxyphenyl)methyl]-methyl-ammonium CAS Name: (5-cyano-3-ethoxycarbonyl-2-methyl-6-sulfanylidene-1-pyridinyl)methyl-[(4-methoxyphenyl)methyl]-methylammonium IUPAC Name: (5-cyano-3-ethoxycarbonyl-2-methyl-6-sulfanylidenepyridin-1-yl)methyl-[(4-methoxyphenyl)methyl]-methylazanium Traditional Name: (3-carbethoxy-5-cyano-2-methyl-6-thioxo-1-pyridyl)methyl-methyl-p-anisyl-ammonium Formula: C20H24N3O3S+ MolecularWeight: 386.48786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)C(=C1)C#N)C[NH+](C)CC2=CC=C(C=C2)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)C(=C1)C#N)C[NH+](C)CC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C20H23N3O3S/c1-5-26-20(24)18-10-16(11-21)19(27)23(14(18)2)13-22(3)12-15-6-8-17(25-4)9-7-15/h6-10H,5,12-13H2,1-4H3/p+1