[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanyl-ethoxysulfanyl-methanone nitrate

Systemtic Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanyl-ethoxysulfanyl-methanone nitrate Openeye Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanyl-ethoxysulfanyl-methanone nitrate CAS Name: [[1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl]thio]-oxomethanesulfenic acid ethyl ester nitrate IUPAC Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl]sulfanyl-ethoxysulfanylmethanone nitrate Traditional Name: [[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]thio]-(ethoxythio)methanone nitrate Formula: C14H14Cl2N3O5S2- MolecularWeight: 439.31406

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Descriptors Computed from Structure

Canonical SMILES:

CCOSC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

CCOSC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C14H14Cl2N2O2S2.NO3/c1-2-20-22-14(19)21-13(8-18-6-5-17-9-18)11-4-3-10(15)7-12(11)16;2-1(3)4/h3-7,9,13H,2,8H2,1H3;/q;-1