4-ethyl-3-(phenylmethyl)-5-propylsulfanyl-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(phenylmethyl)-5-propylsulfanyl-1,2,4-triazole Openeye Name: 3-benzyl-4-ethyl-5-propylsulfanyl-1,2,4-triazole CAS Name: 4-ethyl-3-(phenylmethyl)-5-(propylthio)-1,2,4-triazole IUPAC Name: 3-benzyl-4-ethyl-5-propylsulfanyl-1,2,4-triazole Traditional Name: 3-benzyl-4-ethyl-5-(propylthio)-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1CC)CC2=CC=CC=C2

Isomeric SMILES

CCCSC1=NN=C(N1CC)CC2=CC=CC=C2

InChI

InChI=1S/C14H19N3S/c1-3-10-18-14-16-15-13(17(14)4-2)11-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3