3-[4-[2-(4-butoxyphenyl)ethanoyl]piperazin-1-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[4-[2-(4-butoxyphenyl)ethanoyl]piperazin-1-yl]pyrazine-2-carbonitrile Openeye Name: 3-[4-[2-(4-butoxyphenyl)acetyl]piperazin-1-yl]pyrazine-2-carbonitrile CAS Name: 3-[4-[2-(4-butoxyphenyl)-1-oxoethyl]-1-piperazinyl]-2-pyrazinecarbonitrile IUPAC Name: 3-[4-[2-(4-butoxyphenyl)acetyl]piperazin-1-yl]pyrazine-2-carbonitrile Traditional Name: 3-[4-[2-(4-butoxyphenyl)acetyl]piperazino]pyrazinonitrile Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=NC=CN=C3C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=NC=CN=C3C#N

InChI

InChI=1S/C21H25N5O2/c1-2-3-14-28-18-6-4-17(5-7-18)15-20(27)25-10-12-26(13-11-25)21-19(16-22)23-8-9-24-21/h4-9H,2-3,10-15H2,1H3