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

Systemtic Name: 3-methyl-N-[[5-(naphthalen-1-ylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 3-methyl-N-[[5-(1-naphthylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 3-methyl-N-[[5-(1-naphthalenylmethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 3-methyl-N-[[5-(naphthalen-1-ylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 3-methyl-N-[[5-(1-naphthylmethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C28H24N4OS MolecularWeight: 464.58136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H24N4OS/c1-20-9-7-12-22(17-20)27(33)29-18-26-30-31-28(32(26)24-14-3-2-4-15-24)34-19-23-13-8-11-21-10-5-6-16-25(21)23/h2-17H,18-19H2,1H3,(H,29,33)