N,N-diethyl-2-[[4-(phenylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N,N-diethyl-2-[[4-(phenylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide CAS Name: N,N-diethyl-2-[[4-(phenylmethyl)-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(4-benzyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[[4-benzyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-acetamide Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

CCN(CC)C(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C20H23N5OS/c1-3-24(4-2)18(26)15-27-20-23-22-19(17-12-8-9-13-21-17)25(20)14-16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3