4-ethyl-N-[[4-methyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-ethyl-N-[[4-methyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-ethyl-N-[[4-methyl-5-(3-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-ethyl-N-[[4-methyl-5-(3-pyridinylmethylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-ethyl-N-[[4-methyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-ethyl-N-[[4-methyl-5-(3-pyridylmethylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C)SCC3=CN=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C)SCC3=CN=CC=C3

InChI

InChI=1S/C19H21N5OS/c1-3-14-6-8-16(9-7-14)18(25)21-12-17-22-23-19(24(17)2)26-13-15-5-4-10-20-11-15/h4-11H,3,12-13H2,1-2H3,(H,21,25)