methyl (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoate

Systemtic Name: methyl (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoate Openeye Name: methyl (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoate CAS Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoate Traditional Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]propionic acid methyl ester Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NN=C(N1C)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OC)SC1=NN=C(N1C)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3O2S/c1-9(12(17)18-3)19-13-15-14-11(16(13)2)10-7-5-4-6-8-10/h4-9H,1-3H3/t9-/m1/s1