N-tert-butyl-N-(phenylmethyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-N-(phenylmethyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanamide Openeye Name: N-benzyl-N-tert-butyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-N-(phenylmethyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]acetamide IUPAC Name: N-benzyl-N-tert-butyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]acetamide Traditional Name: N-benzyl-N-tert-butyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]acetamide Formula: C23H29F3N4O MolecularWeight: 434.49777

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CN2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CN2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H29F3N4O/c1-22(2,3)30(16-18-7-5-4-6-8-18)21(31)17-28-11-13-29(14-12-28)20-10-9-19(15-27-20)23(24,25)26/h4-10,15H,11-14,16-17H2,1-3H3