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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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