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

Systemtic Name: phenyl 4-[[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: phenyl 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 phenyl ester IUPAC Name: phenyl 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 phenyl ester Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=N2)NCC3CCN(CC3)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=N2)NCC3CCN(CC3)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C24H26N4O4S/c1-33(30,31)21-9-7-19(8-10-21)22-16-27-23(17-25-22)26-15-18-11-13-28(14-12-18)24(29)32-20-5-3-2-4-6-20/h2-10,16-18H,11-15H2,1H3,(H,26,27)