(2R)-N-methyl-N-(phenylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: (2R)-N-methyl-N-(phenylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: (2R)-N-benzyl-N-methyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: (2R)-N-methyl-N-(phenylmethyl)-2-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: (2R)-N-benzyl-N-methyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: (2R)-N-benzyl-N-methyl-2-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=CC=C1)SC2=NC=NN2

Isomeric SMILES

C[C@H](C(=O)N(C)CC1=CC=CC=C1)SC2=NC=NN2

InChI

InChI=1S/C13H16N4OS/c1-10(19-13-14-9-15-16-13)12(18)17(2)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,14,15,16)/t10-/m1/s1