2-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1,2-bis(4-methylphenyl)ethanone

Systemtic Name: 2-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1,2-bis(4-methylphenyl)ethanone Openeye Name: 2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanyl-1,2-bis(p-tolyl)ethanone CAS Name: 2-[[1-(3-fluorophenyl)-5-tetrazolyl]thio]-1,2-bis(4-methylphenyl)ethanone IUPAC Name: 2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanyl-1,2-bis(4-methylphenyl)ethanone Traditional Name: 2-[[1-(3-fluorophenyl)tetrazol-5-yl]thio]-1,2-bis(p-tolyl)ethanone Formula: C23H19FN4OS MolecularWeight: 418.486563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)SC3=NN=NN3C4=CC(=CC=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)SC3=NN=NN3C4=CC(=CC=C4)F

InChI

InChI=1S/C23H19FN4OS/c1-15-6-10-17(11-7-15)21(29)22(18-12-8-16(2)9-13-18)30-23-25-26-27-28(23)20-5-3-4-19(24)14-20/h3-14,22H,1-2H3