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

Systemtic Name: N-(6-ethoxy-5-nitro-pyrimidin-4-yl)-1,3-benzothiazol-2-amine Openeye Name: N-(6-ethoxy-5-nitro-pyrimidin-4-yl)-1,3-benzothiazol-2-amine CAS Name: N-(6-ethoxy-5-nitro-4-pyrimidinyl)-1,3-benzothiazol-2-amine IUPAC Name: N-(6-ethoxy-5-nitropyrimidin-4-yl)-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-(6-ethoxy-5-nitro-pyrimidin-4-yl)amine Formula: C13H11N5O3S MolecularWeight: 317.32314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H11N5O3S/c1-2-21-12-10(18(19)20)11(14-7-15-12)17-13-16-8-5-3-4-6-9(8)22-13/h3-7H,2H2,1H3,(H,14,15,16,17)