N-[6-(2,2-dimethylhydrazinyl)-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[6-(2,2-dimethylhydrazinyl)-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine Openeye Name: N-[6-(2,2-dimethylhydrazino)-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine CAS Name: N-[6-(2,2-dimethylhydrazinyl)-5-nitro-4-pyrimidinyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[6-(2,2-dimethylhydrazinyl)-5-nitropyrimidin-4-yl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[6-(N',N'-dimethylhydrazino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H13N7O2S MolecularWeight: 331.35302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H13N7O2S/c1-19(2)18-12-10(20(21)22)11(14-7-15-12)17-13-16-8-5-3-4-6-9(8)23-13/h3-7H,1-2H3,(H2,14,15,16,17,18)