(2R)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanoic acid

Systemtic Name: (2R)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanoic acid Openeye Name: (2R)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanoic acid CAS Name: (2R)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]propanoic acid IUPAC Name: (2R)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]propanoic acid Traditional Name: (2R)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]propionic acid Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)O)SC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O2S/c1-12(17(22)23)24-18-19-15(13-8-4-2-5-9-13)16(20-21-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,22,23)/t12-/m1/s1