1-[(E)-3-phenylprop-2-enoyl]-N-[2-(pyrazin-2-ylamino)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[2-(pyrazin-2-ylamino)ethyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[2-(pyrazin-2-ylamino)ethyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-phenylprop-2-enyl]-N-[2-(2-pyrazinylamino)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[2-(pyrazin-2-ylamino)ethyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-phenylacryloyl]-N-[2-(pyrazin-2-ylamino)ethyl]isonipecotamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCNC2=NC=CN=C2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCNC2=NC=CN=C2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H25N5O2/c27-20(7-6-17-4-2-1-3-5-17)26-14-8-18(9-15-26)21(28)25-13-12-24-19-16-22-10-11-23-19/h1-7,10-11,16,18H,8-9,12-15H2,(H,23,24)(H,25,28)/b7-6+