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

Systemtic Name: 1-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-2-one Openeye Name: 1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-one CAS Name: 1-[(1-phenyl-5-tetrazolyl)thio]-2-propanone IUPAC Name: 1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-one Traditional Name: 1-[(1-phenyltetrazol-5-yl)thio]acetone Formula: C10H10N4OS MolecularWeight: 234.2776

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CC(=O)CSC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C10H10N4OS/c1-8(15)7-16-10-11-12-13-14(10)9-5-3-2-4-6-9/h2-6H,7H2,1H3