1-phenyl-5-[3-(2-sulfosulfanylethylamino)propoxy]-1,2,3,4-tetrazole

Systemtic Name: 1-phenyl-5-[3-(2-sulfosulfanylethylamino)propoxy]-1,2,3,4-tetrazole Openeye Name: 1-phenyl-5-[3-(2-sulfosulfanylethylamino)propoxy]tetrazole CAS Name: 1-phenyl-5-[3-[2-(sulfothio)ethylamino]propoxy]tetrazole IUPAC Name: 1-phenyl-5-[3-(2-sulfosulfanylethylamino)propoxy]tetrazole Traditional Name: 1-phenyl-5-[3-[2-(sulfothio)ethylamino]propoxy]tetrazole Formula: C12H17N5O4S2 MolecularWeight: 359.42448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)OCCCNCCSS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)OCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C12H17N5O4S2/c18-23(19,20)22-10-8-13-7-4-9-21-12-14-15-16-17(12)11-5-2-1-3-6-11/h1-3,5-6,13H,4,7-10H2,(H,18,19,20)