(1S)-3-methylsulfanyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]propan-1-amine

Systemtic Name: (1S)-3-methylsulfanyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]propan-1-amine Openeye Name: (1S)-3-methylsulfanyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]propan-1-amine CAS Name: (1S)-3-(methylthio)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-1-propanamine IUPAC Name: (1S)-3-methylsulfanyl-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]propan-1-amine Traditional Name: [(1S)-3-(methylthio)-1-[6-(4-phenylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]propyl]amine Formula: C20H21N5S2 MolecularWeight: 395.54424

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NN=C2N1NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4)N

Isomeric SMILES

CSCC[C@@H](C1=NN=C2N1NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C20H21N5S2/c1-26-12-11-17(21)19-22-23-20-25(19)24-18(13-27-20)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,13,17,24H,11-12,21H2,1H3/t17-/m0/s1