5-butylsulfanyl-1-(4-methylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 5-butylsulfanyl-1-(4-methylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-butylsulfanyl-1-(p-tolyl)tetrazole CAS Name: 5-(butylthio)-1-(4-methylphenyl)tetrazole IUPAC Name: 5-butylsulfanyl-1-(4-methylphenyl)tetrazole Traditional Name: 5-(butylthio)-1-(p-tolyl)tetrazole Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=NN1C2=CC=C(C=C2)C

Isomeric SMILES

CCCCSC1=NN=NN1C2=CC=C(C=C2)C

InChI

InChI=1S/C12H16N4S/c1-3-4-9-17-12-13-14-15-16(12)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3