2-methyl-N-[[5-(oxolan-2-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]propanamide

Systemtic Name: 2-methyl-N-[[5-(oxolan-2-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]propanamide Openeye Name: N-[[4-benzyl-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-propanamide CAS Name: 2-methyl-N-[[5-(2-oxolanylmethylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]propanamide IUPAC Name: N-[[4-benzyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2-methylpropanamide Traditional Name: N-[[4-benzyl-5-(tetrahydrofurfurylthio)-1,2,4-triazol-3-yl]methyl]-2-methyl-propionamide Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC1=NN=C(N1CC2=CC=CC=C2)SCC3CCCO3

Isomeric SMILES

CC(C)C(=O)NCC1=NN=C(N1CC2=CC=CC=C2)SCC3CCCO3

InChI

InChI=1S/C19H26N4O2S/c1-14(2)18(24)20-11-17-21-22-19(26-13-16-9-6-10-25-16)23(17)12-15-7-4-3-5-8-15/h3-5,7-8,14,16H,6,9-13H2,1-2H3,(H,20,24)