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

Systemtic Name: 4-ethyl-N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-4-ethyl-benzamide CAS Name: 4-ethyl-N-[[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-4-ethylbenzamide Traditional Name: N-[[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-4-ethyl-benzamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4OS/c1-3-15-9-11-17(12-10-15)19(25)21-13-18-22-23-20(24(18)2)26-14-16-7-5-4-6-8-16/h4-12H,3,13-14H2,1-2H3,(H,21,25)