(1-methylcyclopropyl) 4-[[5-(2-oxidanylidene-4-propylsulfonyl-piperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: (1-methylcyclopropyl) 4-[[5-(2-oxidanylidene-4-propylsulfonyl-piperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: (1-methylcyclopropyl) 4-[[5-(2-oxo-4-propylsulfonyl-piperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-(2-oxo-4-propylsulfonyl-1-piperazinyl)-2-pyrazinyl]oxymethyl]-1-piperidinecarboxylic acid (1-methylcyclopropyl) ester IUPAC Name: (1-methylcyclopropyl) 4-[[5-(2-oxo-4-propylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(2-keto-4-propylsulfonyl-piperazino)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylic acid (1-methylcyclopropyl) ester Formula: C22H33N5O6S MolecularWeight: 495.59232

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C(=O)C1)C2=CN=C(C=N2)OCC3CCN(CC3)C(=O)OC4(CC4)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C(=O)C1)C2=CN=C(C=N2)OCC3CCN(CC3)C(=O)OC4(CC4)C

InChI

InChI=1S/C22H33N5O6S/c1-3-12-34(30,31)26-10-11-27(20(28)15-26)18-13-24-19(14-23-18)32-16-17-4-8-25(9-5-17)21(29)33-22(2)6-7-22/h13-14,17H,3-12,15-16H2,1-2H3