N-[3-[3-(naphthalen-1-ylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-(naphthalen-1-ylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]phenyl]ethanamide Openeye Name: N-[3-[3-(1-naphthylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]phenyl]acetamide CAS Name: N-[3-[3-(1-naphthalenylmethylthio)-1H-1,2,4-triazol-5-yl]phenyl]acetamide IUPAC Name: N-[3-[3-(naphthalen-1-ylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]phenyl]acetamide Traditional Name: N-[3-[3-(1-naphthylmethylthio)-1H-1,2,4-triazol-5-yl]phenyl]acetamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=NC(=NN2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=NC(=NN2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H18N4OS/c1-14(26)22-18-10-5-8-16(12-18)20-23-21(25-24-20)27-13-17-9-4-7-15-6-2-3-11-19(15)17/h2-12H,13H2,1H3,(H,22,26)(H,23,24,25)