2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-benzyl-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=CN2C

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=CN2C

InChI

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