ethyl 4-[3-[(4-fluorophenyl)methyl-(5-methylpyrazin-2-yl)carbonyl-amino]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(4-fluorophenyl)methyl-(5-methylpyrazin-2-yl)carbonyl-amino]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(4-fluorophenyl)methyl-(5-methylpyrazine-2-carbonyl)amino]propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[(4-fluorophenyl)methyl-[(5-methyl-2-pyrazinyl)-oxomethyl]amino]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-fluorophenyl)methyl-(5-methylpyrazine-2-carbonyl)amino]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(4-fluorobenzyl)-(5-methylpyrazinoyl)amino]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H28FN5O4 MolecularWeight: 457.497923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCN(CC2=CC=C(C=C2)F)C(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCN(CC2=CC=C(C=C2)F)C(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C23H28FN5O4/c1-3-33-23(32)28-12-10-27(11-13-28)21(30)8-9-29(16-18-4-6-19(24)7-5-18)22(31)20-15-25-17(2)14-26-20/h4-7,14-15H,3,8-13,16H2,1-2H3