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

Systemtic Name: 6-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]-N-(4-methylsulfonylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(4-methylsulfonylphenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)piperidino]-5-nitro-pyrimidin-4-yl]-(4-mesylphenyl)amine Formula: C21H23N7O5S MolecularWeight: 485.51622

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCC(CC3)C4=NC(=NO4)C5CC5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCC(CC3)C4=NC(=NO4)C5CC5

InChI

InChI=1S/C21H23N7O5S/c1-34(31,32)16-6-4-15(5-7-16)24-19-17(28(29)30)20(23-12-22-19)27-10-8-14(9-11-27)21-25-18(26-33-21)13-2-3-13/h4-7,12-14H,2-3,8-11H2,1H3,(H,22,23,24)