3-methyl-5-(naphthalen-1-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-methyl-5-(naphthalen-1-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-methyl-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-methyl-5-(1-naphthalenylmethylthio)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-methyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-benzyl-3-methyl-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C21H19N3S MolecularWeight: 345.46066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H19N3S/c1-16-22-23-21(24(16)14-17-8-3-2-4-9-17)25-15-19-12-7-11-18-10-5-6-13-20(18)19/h2-13H,14-15H2,1H3