N1-(4-nitro-1,3-benzothiazol-5-yl)cyclopropane-1,2-diamine

Systemtic Name: N1-(4-nitro-1,3-benzothiazol-5-yl)cyclopropane-1,2-diamine Openeye Name: N1-(4-nitro-1,3-benzothiazol-5-yl)cyclopropane-1,2-diamine CAS Name: N1-(4-nitro-1,3-benzothiazol-5-yl)cyclopropane-1,2-diamine IUPAC Name: 1-N-(4-nitro-1,3-benzothiazol-5-yl)cyclopropane-1,2-diamine Traditional Name: (2-aminocyclopropyl)-(4-nitro-1,3-benzothiazol-5-yl)amine Formula: C10H10N4O2S MolecularWeight: 250.277

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C1NC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-])N

Isomeric SMILES

C1C(C1NC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-])N

InChI

InChI=1S/C10H10N4O2S/c11-5-3-7(5)13-6-1-2-8-9(12-4-17-8)10(6)14(15)16/h1-2,4-5,7,13H,3,11H2