1-phenyl-2-[(1-prop-2-enyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-phenyl-2-[(1-prop-2-enyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 2-(1-allyltetrazol-5-yl)sulfanyl-1-phenyl-ethanone CAS Name: 1-phenyl-2-[(1-prop-2-enyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-phenyl-2-(1-prop-2-enyltetrazol-5-yl)sulfanylethanone Traditional Name: 2-[(1-allyltetrazol-5-yl)thio]-1-phenyl-ethanone Formula: C12H12N4OS MolecularWeight: 260.31488

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=N1)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

C=CCN1C(=NN=N1)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N4OS/c1-2-8-16-12(13-14-15-16)18-9-11(17)10-6-4-3-5-7-10/h2-7H,1,8-9H2