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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCCC2=NN=C(N2C)SCC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCCC2=NN=C(N2C)SCC3=CC=CC=N3

InChI

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