N-(4-pentylphenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(4-pentylphenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-(4-pentylphenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-(4-pentylphenyl)-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-(4-pentylphenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-(4-amylphenyl)-1-pyrazin-2-yl-nipecotamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)C3=NC=CN=C3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)C3=NC=CN=C3

InChI

InChI=1S/C21H28N4O/c1-2-3-4-6-17-8-10-19(11-9-17)24-21(26)18-7-5-14-25(16-18)20-15-22-12-13-23-20/h8-13,15,18H,2-7,14,16H2,1H3,(H,24,26)