3-butylsulfanyl-5-(methoxymethyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-5-(methoxymethyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-butylsulfanyl-5-(methoxymethyl)-4-phenyl-1,2,4-triazole CAS Name: 3-(butylthio)-5-(methoxymethyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-butylsulfanyl-5-(methoxymethyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(butylthio)-5-(methoxymethyl)-4-phenyl-1,2,4-triazole Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C2=CC=CC=C2)COC

Isomeric SMILES

CCCCSC1=NN=C(N1C2=CC=CC=C2)COC

InChI

InChI=1S/C14H19N3OS/c1-3-4-10-19-14-16-15-13(11-18-2)17(14)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3