2,2-dimethylpropyl 4-[[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: 2,2-dimethylpropyl 4-[[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: 2,2-dimethylpropyl 4-[[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[5-(4-methylsulfonylphenyl)-2-pyrazinyl]amino]methyl]-1-piperidinecarboxylic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 4-[[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[5-(4-mesylphenyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylic acid neopentyl ester Formula: C23H32N4O4S MolecularWeight: 460.58958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC(=O)N1CCC(CC1)CNC2=NC=C(N=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)COC(=O)N1CCC(CC1)CNC2=NC=C(N=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H32N4O4S/c1-23(2,3)16-31-22(28)27-11-9-17(10-12-27)13-25-21-15-24-20(14-26-21)18-5-7-19(8-6-18)32(4,29)30/h5-8,14-15,17H,9-13,16H2,1-4H3,(H,25,26)