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

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-[(3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)methyl]-methyl-azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-[(3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl]-methyl-ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-[(3-cyano-4,6-dimethyl-2-sulfanylidene-1-pyridinyl)methyl]-methylammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-[(3-cyano-4,6-dimethyl-2-sulfanylidenepyridin-1-yl)methyl]-methylazanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[(3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl]-methyl-ammonium Formula: C18H21ClN3OS+ MolecularWeight: 362.89684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3OS/c1-12-7-13(2)22(18(24)16(12)9-20)11-21(3)10-14-8-15(19)5-6-17(14)23-4/h5-8H,10-11H2,1-4H3/p+1