4-methyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-propan-2-yl-pyrimidine

Systemtic Name: 4-methyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-propan-2-yl-pyrimidine Openeye Name: 2-isopropyl-4-methyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine CAS Name: 4-methyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-2-propan-2-ylpyrimidine IUPAC Name: 4-methyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-propan-2-ylpyrimidine Traditional Name: 2-isopropyl-4-methyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]pyrimidine Formula: C19H22F3N5O2 MolecularWeight: 409.40549

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22F3N5O2/c1-12(2)18-23-13(3)10-17(24-18)26-8-6-25(7-9-26)15-5-4-14(19(20,21)22)11-16(15)27(28)29/h4-5,10-12H,6-9H2,1-3H3