N6-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-N6-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N4-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 6-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-4-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: isopropyl-[6-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C15H16N6O3S MolecularWeight: 360.39094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C15H16N6O3S/c1-8(2)18-13-12(21(22)23)14(17-7-16-13)20-15-19-10-5-4-9(24-3)6-11(10)25-15/h4-8H,1-3H3,(H2,16,17,18,19,20)