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

Systemtic Name: 1-phenyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfinyl]propan-1-one Openeye Name: 1-phenyl-3-(1-phenyltetrazol-5-yl)sulfinyl-propan-1-one CAS Name: 1-phenyl-3-[(1-phenyl-5-tetrazolyl)sulfinyl]-1-propanone IUPAC Name: 1-phenyl-3-(1-phenyltetrazol-5-yl)sulfinylpropan-1-one Traditional Name: 1-phenyl-3-(1-phenyltetrazol-5-yl)sulfinyl-propan-1-one Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCS(=O)C2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCS(=O)C2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H14N4O2S/c21-15(13-7-3-1-4-8-13)11-12-23(22)16-17-18-19-20(16)14-9-5-2-6-10-14/h1-10H,11-12H2