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

Systemtic Name: 1-(2-oxidanyl-5-propan-2-yl-phenyl)-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 1-(2-hydroxy-5-isopropyl-phenyl)-3-(1-phenyltetrazol-5-yl)sulfanyl-propan-1-one CAS Name: 1-(2-hydroxy-5-propan-2-ylphenyl)-3-[(1-phenyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(2-hydroxy-5-propan-2-ylphenyl)-3-(1-phenyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 1-(2-hydroxy-5-isopropyl-phenyl)-3-[(1-phenyltetrazol-5-yl)thio]propan-1-one Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)O)C(=O)CCSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)O)C(=O)CCSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S/c1-13(2)14-8-9-17(24)16(12-14)18(25)10-11-26-19-20-21-22-23(19)15-6-4-3-5-7-15/h3-9,12-13,24H,10-11H2,1-2H3