6-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]-N-(4-methylsulfonylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(4-methylsulfonylphenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)piperidino]-5-nitro-pyrimidin-4-yl]-(4-mesylphenyl)amine Formula: C22H27N7O5S MolecularWeight: 501.55868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=N1)C2CCN(CC2)C3=C(C(=NC=N3)NC4=CC=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NOC(=N1)C2CCN(CC2)C3=C(C(=NC=N3)NC4=CC=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H27N7O5S/c1-22(2,3)21-26-20(34-27-21)14-9-11-28(12-10-14)19-17(29(30)31)18(23-13-24-19)25-15-5-7-16(8-6-15)35(4,32)33/h5-8,13-14H,9-12H2,1-4H3,(H,23,24,25)