propan-2-yl 4-[(1S)-1-[5-(2-fluoranyl-4-methylsulfonyl-phenyl)pyrazin-2-yl]oxyethyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[(1S)-1-[5-(2-fluoranyl-4-methylsulfonyl-phenyl)pyrazin-2-yl]oxyethyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[(1S)-1-[5-(2-fluoro-4-methylsulfonyl-phenyl)pyrazin-2-yl]oxyethyl]piperidine-1-carboxylate CAS Name: 4-[(1S)-1-[[5-(2-fluoro-4-methylsulfonylphenyl)-2-pyrazinyl]oxy]ethyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(1S)-1-[5-(2-fluoro-4-methylsulfonylphenyl)pyrazin-2-yl]oxyethyl]piperidine-1-carboxylate Traditional Name: 4-[(1S)-1-[5-(2-fluoro-4-mesyl-phenyl)pyrazin-2-yl]oxyethyl]piperidine-1-carboxylic acid isopropyl ester Formula: C22H28FN3O5S MolecularWeight: 465.538223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)C(C)OC2=NC=C(N=C2)C3=C(C=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

C[C@@H](C1CCN(CC1)C(=O)OC(C)C)OC2=NC=C(N=C2)C3=C(C=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C22H28FN3O5S/c1-14(2)30-22(27)26-9-7-16(8-10-26)15(3)31-21-13-24-20(12-25-21)18-6-5-17(11-19(18)23)32(4,28)29/h5-6,11-16H,7-10H2,1-4H3/t15-/m0/s1