2-(5-methylpyrazol-1-yl)-N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]ethanamide

Systemtic Name: 2-(5-methylpyrazol-1-yl)-N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]ethanamide Openeye Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-2-(5-methylpyrazol-1-yl)acetamide CAS Name: 2-(5-methyl-1-pyrazolyl)-N-[[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]acetamide IUPAC Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-2-(5-methylpyrazol-1-yl)acetamide Traditional Name: N-[[4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-2-(5-methylpyrazol-1-yl)acetamide Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CC(=O)NCC2=NN=C(N2CC3=CC=CC=C3)SC

Isomeric SMILES

CC1=CC=NN1CC(=O)NCC2=NN=C(N2CC3=CC=CC=C3)SC

InChI

InChI=1S/C17H20N6OS/c1-13-8-9-19-23(13)12-16(24)18-10-15-20-21-17(25-2)22(15)11-14-6-4-3-5-7-14/h3-9H,10-12H2,1-2H3,(H,18,24)