1-(4-butylphenyl)-2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-butylphenyl)-2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanone Openeye Name: 1-(4-butylphenyl)-2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-ethanone CAS Name: 1-(4-butylphenyl)-2-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]ethanone IUPAC Name: 1-(4-butylphenyl)-2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylethanone Traditional Name: 1-(4-butylphenyl)-2-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]ethanone Formula: C19H19ClN4OS MolecularWeight: 386.89836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN4OS/c1-2-3-4-14-5-7-15(8-6-14)18(25)13-26-19-21-22-23-24(19)17-11-9-16(20)10-12-17/h5-12H,2-4,13H2,1H3