5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1-phenyl-tetrazole CAS Name: 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]-1-phenyltetrazole IUPAC Name: 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1-phenyltetrazole Traditional Name: 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]-1-phenyl-tetrazole Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C16H14N4O2S/c1-2-6-12(7-3-1)20-16(17-18-19-20)23-11-13-10-21-14-8-4-5-9-15(14)22-13/h1-9,13H,10-11H2/t13-/m1/s1