1-butyl-5-[(4-chlorophenyl)sulfanylmethyl]-1,2,3,4-tetrazole

Systemtic Name: 1-butyl-5-[(4-chlorophenyl)sulfanylmethyl]-1,2,3,4-tetrazole Openeye Name: 1-butyl-5-[(4-chlorophenyl)sulfanylmethyl]tetrazole CAS Name: 1-butyl-5-[[(4-chlorophenyl)thio]methyl]tetrazole IUPAC Name: 1-butyl-5-[(4-chlorophenyl)sulfanylmethyl]tetrazole Traditional Name: 1-butyl-5-[[(4-chlorophenyl)thio]methyl]tetrazole Formula: C12H15ClN4S MolecularWeight: 282.7923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H15ClN4S/c1-2-3-8-17-12(14-15-16-17)9-18-11-6-4-10(13)5-7-11/h4-7H,2-3,8-9H2,1H3