[(1S)-2-phenyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]azanium

Systemtic Name: [(1S)-2-phenyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]azanium Openeye Name: [(1S)-2-phenyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]ammonium CAS Name: [(1S)-2-phenyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]ammonium IUPAC Name: [(1S)-2-phenyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]azanium Traditional Name: [(1S)-2-phenyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]ammonium Formula: C24H22N5S+ MolecularWeight: 412.52998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NN=C3N2NC(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C2=NN=C3N2NC(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5)[NH3+]

InChI

InChI=1S/C24H21N5S/c25-21(15-17-7-3-1-4-8-17)23-26-27-24-29(23)28-22(16-30-24)20-13-11-19(12-14-20)18-9-5-2-6-10-18/h1-14,16,21,28H,15,25H2/p+1/t21-/m0/s1