(3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane

CAS Registry Number®

423165-13-3
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CAS Name

(3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane

Molecular Formula

C20H28N4

Molecular Mass

324.46

Cite this Page

(3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=423165-13-3 (retrieved 2024-04-27) (CAS RN: 423165-13-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    148.9 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1/C20H28N4/c1-14(2)20-22-21-15(3)24(20)19-11-17-9-10-18(12-19)23(17)13-16-7-5-4-6-8-16/h4-8,14,17-19H,9-13H2,1-3H3/t17-,18+,19-

InChIKey

InChIKey=YHGHRIAZABSSGB-REPLKXPHNA-N

SMILES

C(C)(C)C=1N(C(C)=NN1)[C@H]2C[C@]3(N(CC4=CC=CC=C4)[C@@](C2)(CC3)[H])[H]

Canonical SMILES

N=1N=C(N(C1C)C2CC3N(CC=4C=CC=CC4)C(CC3)C2)C(C)C

Other Names for this Substance

  • 8-Azabicyclo[3.2.1]octane, 3-[3-methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-, (3-exo)-
  • (3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane

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