N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-pyrazin-2-yl-nipecotamide Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2CCCN(C2)C3=NC=CN=C3)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC(=O)C2CCCN(C2)C3=NC=CN=C3)N(C)C

InChI

InChI=1S/C22H31N5O/c1-4-17-7-9-18(10-8-17)20(26(2)3)14-25-22(28)19-6-5-13-27(16-19)21-15-23-11-12-24-21/h7-12,15,19-20H,4-6,13-14,16H2,1-3H3,(H,25,28)