butyl 4-[(4-pyrazin-2-ylpiperazin-1-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(4-pyrazin-2-ylpiperazin-1-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(4-pyrazin-2-ylpiperazine-1-carbonyl)amino]benzoate CAS Name: 4-[[oxo-[4-(2-pyrazinyl)-1-piperazinyl]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-pyrazin-2-ylpiperazine-1-carbonyl)amino]benzoate Traditional Name: 4-[(4-pyrazin-2-ylpiperazine-1-carbonyl)amino]benzoic acid butyl ester Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=CN=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=CN=C3

InChI

InChI=1S/C20H25N5O3/c1-2-3-14-28-19(26)16-4-6-17(7-5-16)23-20(27)25-12-10-24(11-13-25)18-15-21-8-9-22-18/h4-9,15H,2-3,10-14H2,1H3,(H,23,27)