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

Systemtic Name: N,N-dimethyl-2-[(4-phenethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N,N-dimethyl-2-[[4-phenethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N,N-dimethyl-2-[(4-phenethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N,N-dimethyl-2-[(4-phenethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N,N-dimethyl-2-[[4-phenethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=NN=C(N1CCC2=CC=CC=C2)C3=CC=NC=C3

Isomeric SMILES

CN(C)C(=O)CSC1=NN=C(N1CCC2=CC=CC=C2)C3=CC=NC=C3

InChI

InChI=1S/C19H21N5OS/c1-23(2)17(25)14-26-19-22-21-18(16-8-11-20-12-9-16)24(19)13-10-15-6-4-3-5-7-15/h3-9,11-12H,10,13-14H2,1-2H3