N-(2-fluoranyl-4-propan-2-ylsulfonyl-phenyl)-5-nitro-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(2-fluoranyl-4-propan-2-ylsulfonyl-phenyl)-5-nitro-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidin-4-amine Openeye Name: N-(2-fluoro-4-isopropylsulfonyl-phenyl)-6-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-5-nitro-pyrimidin-4-amine CAS Name: N-(2-fluoro-4-propan-2-ylsulfonylphenyl)-5-nitro-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]-4-pyrimidinamine IUPAC Name: N-(2-fluoro-4-propan-2-ylsulfonylphenyl)-5-nitro-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidin-4-amine Traditional Name: (2-fluoro-4-isopropylsulfonyl-phenyl)-[6-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidino]-5-nitro-pyrimidin-4-yl]amine Formula: C23H28FN7O5S MolecularWeight: 533.575723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28FN7O5S/c1-13(2)20-28-23(36-29-20)15-7-9-30(10-8-15)22-19(31(32)33)21(25-12-26-22)27-18-6-5-16(11-17(18)24)37(34,35)14(3)4/h5-6,11-15H,7-10H2,1-4H3,(H,25,26,27)