[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-[4-(dimethylamino)-3-nitro-phenyl]methanone

Systemtic Name: [4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-[4-(dimethylamino)-3-nitro-phenyl]methanone Openeye Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-[4-(dimethylamino)-3-nitro-phenyl]methanone CAS Name: [4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-[4-(dimethylamino)-3-nitrophenyl]methanone IUPAC Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-[4-(dimethylamino)-3-nitrophenyl]methanone Traditional Name: [4-(5-bromopyrimidin-2-yl)piperazino]-[4-(dimethylamino)-3-nitro-phenyl]methanone Formula: C17H19BrN6O3 MolecularWeight: 435.27516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=N3)Br)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=N3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H19BrN6O3/c1-21(2)14-4-3-12(9-15(14)24(26)27)16(25)22-5-7-23(8-6-22)17-19-10-13(18)11-20-17/h3-4,9-11H,5-8H2,1-2H3