(Z)-(4-chlorophenyl)methyl-[(cyclohexylazaniumyl)-propylsulfanyl-methylidene]azanium dibromide

Systemtic Name: (Z)-(4-chlorophenyl)methyl-[(cyclohexylazaniumyl)-propylsulfanyl-methylidene]azanium dibromide Openeye Name: (Z)-(4-chlorophenyl)methyl-[(cyclohexylammonio)-propylsulfanyl-methylene]ammonium dibromide CAS Name: (Z)-(4-chlorophenyl)methyl-[(cyclohexylammonio)-(propylthio)methylidene]ammonium dibromide IUPAC Name: (Z)-(4-chlorophenyl)methyl-[(cyclohexylazaniumyl)-propylsulfanylmethylidene]azanium dibromide Traditional Name: (Z)-(4-chlorobenzyl)-[(cyclohexylammonio)-(propylthio)methylene]ammonium dibromide Formula: C17H27Br2ClN2S MolecularWeight: 486.73568

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=[NH+]CC1=CC=C(C=C1)Cl)[NH2+]C2CCCCC2.[Br-].[Br-]

Isomeric SMILES

CCCS/C(=[NH+]\CC1=CC=C(C=C1)Cl)/[NH2+]C2CCCCC2.[Br-].[Br-]

InChI

InChI=1S/C17H25ClN2S.2BrH/c1-2-12-21-17(20-16-6-4-3-5-7-16)19-13-14-8-10-15(18)11-9-14;;/h8-11,16H,2-7,12-13H2,1H3,(H,19,20);2*1H