3-[(3-bromanylphenoxy)methyl]-5-[[(2R)-oxan-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-bromanylphenoxy)methyl]-5-[[(2R)-oxan-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(3-bromophenoxy)methyl]-5-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(3-bromophenoxy)methyl]-5-[[(2R)-2-oxanyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-bromophenoxy)methyl]-5-[[(2R)-oxan-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(3-bromophenoxy)methyl]-5-[[(2R)-tetrahydropyran-2-yl]methylthio]-1,2,4-triazol-4-yl]amine Formula: C15H19BrN4O2S MolecularWeight: 399.30596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2N)COC3=CC(=CC=C3)Br

Isomeric SMILES

C1CCO[C@H](C1)CSC2=NN=C(N2N)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C15H19BrN4O2S/c16-11-4-3-6-12(8-11)22-9-14-18-19-15(20(14)17)23-10-13-5-1-2-7-21-13/h3-4,6,8,13H,1-2,5,7,9-10,17H2/t13-/m1/s1