[(1S)-2-phenyl-1-[6-(phenylmethylsulfanyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]ethyl]azanium

Systemtic Name: [(1S)-2-phenyl-1-[6-(phenylmethylsulfanyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]ethyl]azanium Openeye Name: [(1S)-1-(6-benzylsulfanyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-2-phenyl-ethyl]ammonium CAS Name: [(1S)-2-phenyl-1-[6-(phenylmethylthio)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]ethyl]ammonium IUPAC Name: [(1S)-1-(6-benzylsulfanyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-2-phenylethyl]azanium Traditional Name: [(1S)-1-[6-(benzylthio)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-2-phenyl-ethyl]ammonium Formula: C18H18N5S2+ MolecularWeight: 368.49902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NN=C3N2N=C(S3)SCC4=CC=CC=C4)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C2=NN=C3N2N=C(S3)SCC4=CC=CC=C4)[NH3+]

InChI

InChI=1S/C18H17N5S2/c19-15(11-13-7-3-1-4-8-13)16-20-21-17-23(16)22-18(25-17)24-12-14-9-5-2-6-10-14/h1-10,15H,11-12,19H2/p+1/t15-/m0/s1