(4-chloranyl-3-nitro-phenyl)-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[4-(2,6-dimethyl-5-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[4-(2,6-dimethyl-5-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazino]methanone Formula: C20H24ClN5O3 MolecularWeight: 417.88926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C20H24ClN5O3/c1-12(2)18-13(3)22-14(4)23-19(18)24-7-9-25(10-8-24)20(27)15-5-6-16(21)17(11-15)26(28)29/h5-6,11-12H,7-10H2,1-4H3