tert-butyl 4-[5-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[5-methyl-6-(4-methylsulfonyl-1-piperazinyl)-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[6-(4-mesylpiperazino)-5-methyl-pyrimidin-4-yl]oxypiperidine-1-carboxylic acid tert-butyl ester Formula: C20H33N5O5S MolecularWeight: 455.57152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN=C1OC2CCN(CC2)C(=O)OC(C)(C)C)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(N=CN=C1OC2CCN(CC2)C(=O)OC(C)(C)C)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C20H33N5O5S/c1-15-17(23-10-12-25(13-11-23)31(5,27)28)21-14-22-18(15)29-16-6-8-24(9-7-16)19(26)30-20(2,3)4/h14,16H,6-13H2,1-5H3