N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-4-nitro-benzamide Openeye Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-4-nitro-benzamide CAS Name: N-[4-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-4-nitrobenzamide Traditional Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-4-nitro-benzamide Formula: C20H20N6O3 MolecularWeight: 392.4112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)C)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)C)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O3/c1-13-21-18(12-19(22-13)25(2)3)23-15-6-8-16(9-7-15)24-20(27)14-4-10-17(11-5-14)26(28)29/h4-12H,1-3H3,(H,24,27)(H,21,22,23)