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

Systemtic Name: 4-[[1-(3-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-phenyl-butan-1-one Openeye Name: 4-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-1-phenyl-butan-1-one CAS Name: 4-[[1-(3-chlorophenyl)-5-tetrazolyl]thio]-1-phenyl-1-butanone IUPAC Name: 4-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-1-phenylbutan-1-one Traditional Name: 4-[[1-(3-chlorophenyl)tetrazol-5-yl]thio]-1-phenyl-butan-1-one Formula: C17H15ClN4OS MolecularWeight: 358.8452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCSC2=NN=NN2C3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCSC2=NN=NN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H15ClN4OS/c18-14-8-4-9-15(12-14)22-17(19-20-21-22)24-11-5-10-16(23)13-6-2-1-3-7-13/h1-4,6-9,12H,5,10-11H2