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5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium

5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium

Systemtic Name:5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium
Openeye Name:5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylammonium
CAS Name:5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylammonium
IUPAC Name:5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium
Traditional Name:5-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylammonium
Formula: C21H24N5S+
MolecularWeight: 378.51376
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC4=NN=C(N4N3)CCCCC[NH3+]


Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC4=NN=C(N4N3)CCCCC[NH3+]


InChI

InChI=1S/C21H23N5S/c22-14-6-2-5-9-20-23-24-21-26(20)25-19(15-27-21)18-12-10-17(11-13-18)16-7-3-1-4-8-16/h1,3-4,7-8,10-13,15,25H,2,5-6,9,14,22H2/p+1


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