[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone

Systemtic Name: [4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone Openeye Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone CAS Name: [4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-(2,3-diethyl-6-quinoxalinyl)methanone IUPAC Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone Traditional Name: [4-(5-bromopyrimidin-2-yl)piperazino]-(2,3-diethylquinoxalin-6-yl)methanone Formula: C21H23BrN6O MolecularWeight: 455.35092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br)N=C1CC

InChI

InChI=1S/C21H23BrN6O/c1-3-16-17(4-2)26-19-11-14(5-6-18(19)25-16)20(29)27-7-9-28(10-8-27)21-23-12-15(22)13-24-21/h5-6,11-13H,3-4,7-10H2,1-2H3