2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-phenyl-propan-1-one

Systemtic Name: 2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-phenyl-propan-1-one Openeye Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-phenyl-propan-1-one CAS Name: 2-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]-1-phenyl-1-propanone IUPAC Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-phenylpropan-1-one Traditional Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]-1-phenyl-propan-1-one Formula: C16H13ClN4OS MolecularWeight: 344.81862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NN=NN2C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NN=NN2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS/c1-11(15(22)12-5-3-2-4-6-12)23-16-18-19-20-21(16)14-9-7-13(17)8-10-14/h2-11H,1H3