N-(2-chloranyl-4-nitro-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C17H19ClN6O3 MolecularWeight: 390.82416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H19ClN6O3/c1-12(16(25)21-15-4-3-13(24(26)27)11-14(15)18)22-7-9-23(10-8-22)17-19-5-2-6-20-17/h2-6,11-12H,7-10H2,1H3,(H,21,25)