propan-2-yl 4-[2-[6-(4-methylsulfonylpiperazin-1-yl)pyridin-3-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[2-[6-(4-methylsulfonylpiperazin-1-yl)pyridin-3-yl]ethyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[2-[6-(4-methylsulfonylpiperazin-1-yl)-3-pyridyl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[6-(4-methylsulfonyl-1-piperazinyl)-3-pyridinyl]ethyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-[6-(4-methylsulfonylpiperazin-1-yl)pyridin-3-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[6-(4-mesylpiperazino)-3-pyridyl]ethyl]piperidine-1-carboxylic acid isopropyl ester Formula: C21H34N4O4S MolecularWeight: 438.58406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)CCC2=CN=C(C=C2)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)CCC2=CN=C(C=C2)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H34N4O4S/c1-17(2)29-21(26)24-10-8-18(9-11-24)4-5-19-6-7-20(22-16-19)23-12-14-25(15-13-23)30(3,27)28/h6-7,16-18H,4-5,8-15H2,1-3H3