N-[(2R)-1-azido-3-thiophen-2-yl-propan-2-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(2R)-1-azido-3-thiophen-2-yl-propan-2-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[(1R)-1-(azidomethyl)-2-(2-thienyl)ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[(2R)-1-azido-3-thiophen-2-ylpropan-2-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(2R)-1-azido-3-thiophen-2-ylpropan-2-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[(1R)-1-(azidomethyl)-2-(2-thienyl)ethyl]-2-nitro-benzenesulfonamide Formula: C13H13N5O4S2 MolecularWeight: 367.40342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC(CC2=CC=CS2)CN=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N[C@H](CC2=CC=CS2)CN=[N+]=[N-]

InChI

InChI=1S/C13H13N5O4S2/c14-17-15-9-10(8-11-4-3-7-23-11)16-24(21,22)13-6-2-1-5-12(13)18(19)20/h1-7,10,16H,8-9H2/t10-/m1/s1