3-butylsulfanyl-5-(phenoxymethyl)-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-5-(phenoxymethyl)-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-butylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole CAS Name: 3-(butylthio)-5-(phenoxymethyl)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-butylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole Traditional Name: 4-benzyl-3-(butylthio)-5-(phenoxymethyl)-1,2,4-triazole Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1CC2=CC=CC=C2)COC3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NN=C(N1CC2=CC=CC=C2)COC3=CC=CC=C3

InChI

InChI=1S/C20H23N3OS/c1-2-3-14-25-20-22-21-19(16-24-18-12-8-5-9-13-18)23(20)15-17-10-6-4-7-11-17/h4-13H,2-3,14-16H2,1H3