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

Systemtic Name: 4-chloranyl-N-[[4-methyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[4-methyl-5-(1-naphthylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-chloro-N-[[4-methyl-5-(1-naphthalenylmethylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-chloro-N-[[4-methyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[4-methyl-5-(1-naphthylmethylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C22H19ClN4OS MolecularWeight: 422.93046

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)CNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)CNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN4OS/c1-27-20(13-24-21(28)16-9-11-18(23)12-10-16)25-26-22(27)29-14-17-7-4-6-15-5-2-3-8-19(15)17/h2-12H,13-14H2,1H3,(H,24,28)