[(5-bromanyl-2-oxidanyl-cyclohexyl)methylazanidylamino]-methylsulfanyl-methanethiolate; vanadium(2+); trihydrate

Systemtic Name: [(5-bromanyl-2-oxidanyl-cyclohexyl)methylazanidylamino]-methylsulfanyl-methanethiolate; vanadium(2+); trihydrate Openeye Name: [(5-bromo-2-hydroxy-cyclohexyl)methylazanidylamino]-methylsulfanyl-methanethiolate; vanadium(2+); trihydrate CAS Name: [(5-bromo-2-hydroxycyclohexyl)methylazanidylamino]-(methylthio)methanethiolate; vanadium(2+); trihydrate IUPAC Name: [(5-bromo-2-hydroxycyclohexyl)methylazanidylamino]-methylsulfanylmethanethiolate; vanadium(2+); trihydrate Traditional Name: [(5-bromo-2-hydroxy-cyclohexyl)methylazanidylamino]-(methylthio)methanethiolate; vanadium(2+); trihydrate Formula: C18H40Br2N4O5S4V2 MolecularWeight: 782.485

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Descriptors Computed from Structure

Canonical SMILES:

CSC(N[N-]CC1CC(CCC1O)Br)[S-].CSC(N[N-]CC1CC(CCC1O)Br)[S-].O.O.O.[V+2].[V+2]

Isomeric SMILES

CSC(N[N-]CC1CC(CCC1O)Br)[S-].CSC(N[N-]CC1CC(CCC1O)Br)[S-].O.O.O.[V+2].[V+2]

InChI

InChI=1S/2C9H18BrN2OS2.3H2O.2V/c2*1-15-9(14)12-11-5-6-4-7(10)2-3-8(6)13;;;;;/h2*6-9,12-14H,2-5H2,1H3;3*1H2;;/q2*-1;;;;2*+2/p-2