6-(4-bromophenyl)-3-[(2R)-pyrrolidin-1-ium-2-yl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Systemtic Name: 6-(4-bromophenyl)-3-[(2R)-pyrrolidin-1-ium-2-yl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine Openeye Name: 6-(4-bromophenyl)-3-[(2R)-pyrrolidin-1-ium-2-yl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine CAS Name: 6-(4-bromophenyl)-3-[(2R)-2-pyrrolidin-1-iumyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine IUPAC Name: 6-(4-bromophenyl)-3-[(2R)-pyrrolidin-1-ium-2-yl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine Traditional Name: 6-(4-bromophenyl)-3-[(2R)-pyrrolidin-1-ium-2-yl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine Formula: C14H15BrN5S+ MolecularWeight: 365.2714

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=NN=C3N2NC(=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C2=NN=C3N2NC(=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C14H14BrN5S/c15-10-5-3-9(4-6-10)12-8-21-14-18-17-13(20(14)19-12)11-2-1-7-16-11/h3-6,8,11,16,19H,1-2,7H2/p+1/t11-/m1/s1