ethyl 1-[3-[(5-methylpyrazin-2-yl)carbonyl-phenethyl-amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[(5-methylpyrazin-2-yl)carbonyl-phenethyl-amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(5-methylpyrazine-2-carbonyl)-phenethyl-amino]propanoyl]piperidine-4-carboxylate CAS Name: 1-[3-[[(5-methyl-2-pyrazinyl)-oxomethyl]-phenethylamino]-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(5-methylpyrazine-2-carbonyl)-phenethylamino]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[(5-methylpyrazinoyl)-phenethyl-amino]propanoyl]isonipecotic acid ethyl ester Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCN(CCC2=CC=CC=C2)C(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCN(CCC2=CC=CC=C2)C(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C25H32N4O4/c1-3-33-25(32)21-10-14-28(15-11-21)23(30)12-16-29(13-9-20-7-5-4-6-8-20)24(31)22-18-26-19(2)17-27-22/h4-8,17-18,21H,3,9-16H2,1-2H3