6-isothiocyanato-3-(1-phenyl-1,2,3,4-tetrazol-5-yl)-3-azabicyclo[3.1.0]hexane

Systemtic Name: 6-isothiocyanato-3-(1-phenyl-1,2,3,4-tetrazol-5-yl)-3-azabicyclo[3.1.0]hexane Openeye Name: 6-isothiocyanato-3-(1-phenyltetrazol-5-yl)-3-azabicyclo[3.1.0]hexane CAS Name: 6-isothiocyanato-3-(1-phenyl-5-tetrazolyl)-3-azabicyclo[3.1.0]hexane IUPAC Name: 6-isothiocyanato-3-(1-phenyltetrazol-5-yl)-3-azabicyclo[3.1.0]hexane Traditional Name: 6-isothiocyanato-3-(1-phenyltetrazol-5-yl)-3-azabicyclo[3.1.0]hexane Formula: C13H12N6S MolecularWeight: 284.33958

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C2N=C=S)CN1C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1C2C(C2N=C=S)CN1C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C13H12N6S/c20-8-14-12-10-6-18(7-11(10)12)13-15-16-17-19(13)9-4-2-1-3-5-9/h1-5,10-12H,6-7H2