[3-ethoxy-4-(2-methylpropoxy)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone Openeye Name: (3-ethoxy-4-isobutoxy-phenyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone CAS Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-(2-pyrazinyl)-1-piperazinyl]methanone IUPAC Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone Traditional Name: (3-ethoxy-4-isobutoxy-phenyl)-(4-pyrazin-2-ylpiperazino)methanone Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=NC=CN=C3)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=NC=CN=C3)OCC(C)C

InChI

InChI=1S/C21H28N4O3/c1-4-27-19-13-17(5-6-18(19)28-15-16(2)3)21(26)25-11-9-24(10-12-25)20-14-22-7-8-23-20/h5-8,13-14,16H,4,9-12,15H2,1-3H3