1-(3-chlorophenyl)-5-pentylsulfanyl-1,2,3,4-tetrazole

Systemtic Name: 1-(3-chlorophenyl)-5-pentylsulfanyl-1,2,3,4-tetrazole Openeye Name: 1-(3-chlorophenyl)-5-pentylsulfanyl-tetrazole CAS Name: 1-(3-chlorophenyl)-5-(pentylthio)tetrazole IUPAC Name: 1-(3-chlorophenyl)-5-pentylsulfanyltetrazole Traditional Name: 5-(amylthio)-1-(3-chlorophenyl)tetrazole Formula: C12H15ClN4S MolecularWeight: 282.7923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NN=NN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCCSC1=NN=NN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H15ClN4S/c1-2-3-4-8-18-12-14-15-16-17(12)11-7-5-6-10(13)9-11/h5-7,9H,2-4,8H2,1H3