6-methoxy-N-[6-(2-methylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine

Systemtic Name: 6-methoxy-N-[6-(2-methylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine Openeye Name: 6-methoxy-N-[6-[(2-methyl-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine CAS Name: 6-methoxy-N-[6-[(2-methyl-8-quinolinyl)oxy]-5-nitro-4-pyrimidinyl]-1,3-benzothiazol-2-amine IUPAC Name: 6-methoxy-N-[6-(2-methylquinolin-8-yl)oxy-5-nitropyrimidin-4-yl]-1,3-benzothiazol-2-amine Traditional Name: (6-methoxy-1,3-benzothiazol-2-yl)-[6-[(2-methyl-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]amine Formula: C22H16N6O4S MolecularWeight: 460.46524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NC4=NC5=C(S4)C=C(C=C5)OC)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NC4=NC5=C(S4)C=C(C=C5)OC)C=C1

InChI

InChI=1S/C22H16N6O4S/c1-12-6-7-13-4-3-5-16(18(13)25-12)32-21-19(28(29)30)20(23-11-24-21)27-22-26-15-9-8-14(31-2)10-17(15)33-22/h3-11H,1-2H3,(H,23,24,26,27)