propan-2-yl 4-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-(4-methylsulfonylphenyl)-2-pyrazinyl]oxymethyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylic acid isopropyl ester Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)COC2=NC=C(N=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)COC2=NC=C(N=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O5S/c1-15(2)29-21(25)24-10-8-16(9-11-24)14-28-20-13-22-19(12-23-20)17-4-6-18(7-5-17)30(3,26)27/h4-7,12-13,15-16H,8-11,14H2,1-3H3