(1R,5S)-6-[(2-methoxyphenyl)methyl]-7-[4-(3-pyridinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane (Q27222463)

BRD-K64639565-001-01-8 (English)

12 October 2016

chemical formula

C₂₄H₂₅N₃O

1 reference

BRD-K64639565-001-01-8 (English)

12 October 2016

canonical SMILES

COC1=CC=CC=C1CN2C3CNCC2C3C4=CC=C(C=C4)C5=CN=CC=C5

1 reference

BRD-K64639565-001-01-8 (English)

12 October 2016

isomeric SMILES

COC1=CC=CC=C1CN2[C@@H]3CNC[C@H]2C3C4=CC=C(C=C4)C5=CN=CC=C5

1 reference

BRD-K64639565-001-01-8 (English)

InChI=1S/C24H25N3O/c1-28-23-7-3-2-5-20(23)16-27-21-14-26-15-22(27)24(21)18-10-8-17(9-11-18)19-6-4-12-25-13-19/h2-13,21-22,24,26H,14-16H2,1H3/t21-,22+,24?

12 October 2016

Identifiers

InChI

1 reference

BRD-K64639565-001-01-8 (English)

FUVVHTHCAJYJCG-RIKCKFAHSA-N

12 October 2016

InChIKey

2 references

BRD-K64639565-001-01-8 (English)

12 October 2016

stated in

ChEBI release 2020-09-01

1 reference

BRD-K64639565-001-01-8 (English)

12 October 2016

ChEBI ID

129249

mapping relation type

2 references

(1R,5S)-6-[(2-methoxyphenyl)methyl]-7-[4-(3-pyridinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane (English)