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

Systemtic Name: (1S)-2-(1H-indol-3-yl)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethanamine Openeye Name: (1S)-2-(1H-indol-3-yl)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethanamine CAS Name: (1S)-2-(1H-indol-3-yl)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethanamine IUPAC Name: (1S)-2-(1H-indol-3-yl)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethanamine Traditional Name: [(1S)-2-(1H-indol-3-yl)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]amine Formula: C26H22N6S MolecularWeight: 450.55808

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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)C(CC5=CNC6=CC=CC=C65)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC4=NN=C(N4N3)[C@H](CC5=CNC6=CC=CC=C65)N

InChI

InChI=1S/C26H22N6S/c27-22(14-20-15-28-23-9-5-4-8-21(20)23)25-29-30-26-32(25)31-24(16-33-26)19-12-10-18(11-13-19)17-6-2-1-3-7-17/h1-13,15-16,22,28,31H,14,27H2/t22-/m0/s1