N-butyl-2-[[4-(furan-2-ylmethyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-butyl-2-[[4-(furan-2-ylmethyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-benzyl-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-butyl-acetamide CAS Name: N-butyl-2-[[4-(2-furanylmethyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-benzyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-butylacetamide Traditional Name: 2-[[5-benzyl-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-butyl-acetamide Formula: C20H24N4O2S MolecularWeight: 384.49516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN=C(N1CC2=CC=CO2)CC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)CSC1=NN=C(N1CC2=CC=CO2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N4O2S/c1-2-3-11-21-19(25)15-27-20-23-22-18(13-16-8-5-4-6-9-16)24(20)14-17-10-7-12-26-17/h4-10,12H,2-3,11,13-15H2,1H3,(H,21,25)