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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H22N8O2
Molecular Weight 370.409
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-[[(3R,4R)-1-(2-Cyanoacetyl)-4-methyl-3-piperidinyl]methylamino]-7H-pyrrolo[2,3-d]pyrimidine-7-carboxylic acid hydrazide

SMILES

C[C@@H]1CCN(C[C@@H]1N(C)C2=C3C=CN(C(=O)NN)C3=NC=N2)C(=O)CC#N

InChI

InChIKey=MFKCCDWSXLIVDS-YPMHNXCESA-N
InChI=1S/C17H22N8O2/c1-11-4-7-24(14(26)3-6-18)9-13(11)23(2)15-12-5-8-25(17(27)22-19)16(12)21-10-20-15/h5,8,10-11,13H,3-4,7,9,19H2,1-2H3,(H,22,27)/t11-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H22N8O2
Molecular Weight 370.409
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:35:18 UTC 2023
Edited
by admin
on Sat Dec 16 19:35:18 UTC 2023
Record UNII
VH64X8MX6G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[[(3R,4R)-1-(2-Cyanoacetyl)-4-methyl-3-piperidinyl]methylamino]-7H-pyrrolo[2,3-d]pyrimidine-7-carboxylic acid hydrazide
Systematic Name English
7H-Pyrrolo[2,3-d]pyrimidine-7-carboxylic acid, 4-[[(3R,4R)-1-(2-cyanoacetyl)-4-methyl-3-piperidinyl]methylamino]-, hydrazide
Systematic Name English
Code System Code Type Description
FDA UNII
VH64X8MX6G
Created by admin on Sat Dec 16 19:35:18 UTC 2023 , Edited by admin on Sat Dec 16 19:35:18 UTC 2023
PRIMARY
CAS
2758773-70-3
Created by admin on Sat Dec 16 19:35:18 UTC 2023 , Edited by admin on Sat Dec 16 19:35:18 UTC 2023
PRIMARY
PUBCHEM
166946607
Created by admin on Sat Dec 16 19:35:18 UTC 2023 , Edited by admin on Sat Dec 16 19:35:18 UTC 2023
PRIMARY
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