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

Systemtic Name: N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N4-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 6-N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-4-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: isopropyl-[6-[(4-methyl-1,3-benzothiazol-2-yl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C15H16N6O2S MolecularWeight: 344.39154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H16N6O2S/c1-8(2)18-13-12(21(22)23)14(17-7-16-13)20-15-19-11-9(3)5-4-6-10(11)24-15/h4-8H,1-3H3,(H2,16,17,18,19,20)