[1-[(4-ethylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium dichloride

Systemtic Name: [1-[(4-ethylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium dichloride Openeye Name: [1-[(4-ethylsulfanylpyridin-1-ium-1-yl)methoxymethyl]-4-pyridylidene]methyl-oxo-ammonium dichloride CAS Name: [1-[[4-(ethylthio)-1-pyridin-1-iumyl]methoxymethyl]-4-pyridinylidene]methyl-oxoammonium dichloride IUPAC Name: [1-[(4-ethylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-4-ylidene]methyl-oxoazanium dichloride Traditional Name: [1-[[4-(ethylthio)pyridin-1-ium-1-yl]methoxymethyl]-4-pyridylidene]methyl-keto-ammonium dichloride Formula: C15H19Cl2N3O2S MolecularWeight: 376.30126

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=[N+](C=C1)COCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-]

Isomeric SMILES

CCSC1=CC=[N+](C=C1)COCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-]

InChI

InChI=1S/C15H18N3O2S.2ClH/c1-2-21-15-5-9-18(10-6-15)13-20-12-17-7-3-14(4-8-17)11-16-19;;/h3-11H,2,12-13H2,1H3;2*1H/q+1;;/p-1