6-[(2-fluorophenyl)methyl]-5-methyl-N-(3-methylbutyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (Q27185635)

SMR000132085 (English)

10 October 2016

chemical formula

C₂₀H₂₃FN₄O₂

1 reference

SMR000132085 (English)

10 October 2016

canonical SMILES

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)NCCC(C)C)CC3=CC=CC=C3F

1 reference

SMR000132085 (English)

10 October 2016

isomeric SMILES

FC1=CC=CC=C1CC=2C(=O)N/3N/C=C(\C3=N\C2C)/C(=O)NCCC(C)C

1 reference

6-(2-Fluorobenzyl)-5-methyl-N-(3-methylbutyl)-7-oxo-1,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxamide (English)

InChI=1S/C20H23FN4O2/c1-12(2)8-9-22-19(26)16-11-23-25-18(16)24-13(3)15(20(25)27)10-14-6-4-5-7-17(14)21/h4-7,11-12,23H,8-10H2,1-3H3,(H,22,26)

10 October 2016

Identifiers

InChI

1 reference

SMR000132085 (English)

GODAWFBSXWZMCH-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

SMR000132085 (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

6-(2-Fluorobenzyl)-5-methyl-N-(3-methylbutyl)-7-oxo-1,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxamide (English)

10 October 2016

2 references

SMR000132085 (English)

matched by identifier from

10 October 2016

InChIKey

GODAWFBSXWZMCH-UHFFFAOYSA-N

ChEBI ID

107338

mapping relation type

2 references

6-[(2-fluorophenyl)methyl]-5-methyl-N-(3-methylbutyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (English)