2-[1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Formula: C22H27N7O3 MolecularWeight: 437.49488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(C)C3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(C)C3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H27N7O3/c1-14(2)20-23-15(3)13-19(24-20)28-11-9-27(10-12-28)16(4)21-25-26-22(32-21)17-5-7-18(8-6-17)29(30)31/h5-8,13-14,16H,9-12H2,1-4H3