N-[[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]propanamide

Systemtic Name: N-[[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]propanamide Openeye Name: N-[(4-isobutyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)methyl]propanamide CAS Name: N-[[4-(2-methylpropyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]propanamide IUPAC Name: N-[[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]propanamide Traditional Name: N-[[4-isobutyl-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]propionamide Formula: C18H26N4OS MolecularWeight: 346.49024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC1=NN=C(N1CC(C)C)SCCC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NCC1=NN=C(N1CC(C)C)SCCC2=CC=CC=C2

InChI

InChI=1S/C18H26N4OS/c1-4-17(23)19-12-16-20-21-18(22(16)13-14(2)3)24-11-10-15-8-6-5-7-9-15/h5-9,14H,4,10-13H2,1-3H3,(H,19,23)