3-ethyl-4-phenyl-5-propylsulfanyl-1,2,4-triazole

Systemtic Name: 3-ethyl-4-phenyl-5-propylsulfanyl-1,2,4-triazole Openeye Name: 3-ethyl-4-phenyl-5-propylsulfanyl-1,2,4-triazole CAS Name: 3-ethyl-4-phenyl-5-(propylthio)-1,2,4-triazole IUPAC Name: 3-ethyl-4-phenyl-5-propylsulfanyl-1,2,4-triazole Traditional Name: 3-ethyl-4-phenyl-5-(propylthio)-1,2,4-triazole Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=CC=C2)CC

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=CC=C2)CC

InChI

InChI=1S/C13H17N3S/c1-3-10-17-13-15-14-12(4-2)16(13)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3