(1-methylcyclopropyl) 4-[[6-chloranyl-5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: (1-methylcyclopropyl) 4-[[6-chloranyl-5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: (1-methylcyclopropyl) 4-[[6-chloro-5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[6-chloro-5-(4-methylsulfonyl-1-piperazinyl)-2-pyrazinyl]oxymethyl]-1-piperidinecarboxylic acid (1-methylcyclopropyl) ester IUPAC Name: (1-methylcyclopropyl) 4-[[6-chloro-5-(4-methylsulfonylpiperazin-1-yl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[6-chloro-5-(4-mesylpiperazino)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylic acid (1-methylcyclopropyl) ester Formula: C20H30ClN5O5S MolecularWeight: 488.0007

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)OC(=O)N2CCC(CC2)COC3=CN=C(C(=N3)Cl)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1(CC1)OC(=O)N2CCC(CC2)COC3=CN=C(C(=N3)Cl)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C20H30ClN5O5S/c1-20(5-6-20)31-19(27)25-7-3-15(4-8-25)14-30-16-13-22-18(17(21)23-16)24-9-11-26(12-10-24)32(2,28)29/h13,15H,3-12,14H2,1-2H3