ethyl (3R)-1-[3-[butyl-(5-methylpyrazin-2-yl)carbonyl-amino]propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-1-[3-[butyl-(5-methylpyrazin-2-yl)carbonyl-amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3R)-1-[3-[butyl-(5-methylpyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate CAS Name: (3R)-1-[3-[butyl-[(5-methyl-2-pyrazinyl)-oxomethyl]amino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[3-[butyl-(5-methylpyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate Traditional Name: (3R)-1-[3-[butyl-(5-methylpyrazinoyl)amino]propanoyl]nipecotic acid ethyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)N1CCCC(C1)C(=O)OCC)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CCCCN(CCC(=O)N1CCC[C@H](C1)C(=O)OCC)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C21H32N4O4/c1-4-6-10-24(20(27)18-14-22-16(3)13-23-18)12-9-19(26)25-11-7-8-17(15-25)21(28)29-5-2/h13-14,17H,4-12,15H2,1-3H3/t17-/m1/s1