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Details

Stereochemistry ACHIRAL
Molecular Formula C34H37N9O4
Molecular Weight 635.7155
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-PYRIMIDINECARBOXAMIDE, N-(4-(4-AMINO-7-(1-(2-METHYL-1-OXOPROPYL)-4-PIPERIDINYL)PYRROLO(2,1-F)(1,2,4)TRIAZIN-5-YL)PHENYL)-1,2,3,4-TETRAHYDRO-1-(1-METHYLETHYL)-2,4-DIOXO-3-(2-PYRIDINYL)-

SMILES

CC(C)N1C=C(C(=O)NC2=CC=C(C=C2)C3=C4N(N=CN=C4N)C(=C3)C5CCN(CC5)C(=O)C(C)C)C(=O)N(C1=O)C6=NC=CC=C6

InChI

InChIKey=QEVGUJYKDITCHE-UHFFFAOYSA-N
InChI=1S/C34H37N9O4/c1-20(2)32(45)40-15-12-23(13-16-40)27-17-25(29-30(35)37-19-38-43(27)29)22-8-10-24(11-9-22)39-31(44)26-18-41(21(3)4)34(47)42(33(26)46)28-7-5-6-14-36-28/h5-11,14,17-21,23H,12-13,15-16H2,1-4H3,(H,39,44)(H2,35,37,38)

HIDE SMILES / InChI

Molecular Formula C34H37N9O4
Molecular Weight 635.7155
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:08:26 GMT 2023
Edited
by admin
on Sat Dec 16 14:08:26 GMT 2023
Record UNII
3OGC49TNT5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-PYRIMIDINECARBOXAMIDE, N-(4-(4-AMINO-7-(1-(2-METHYL-1-OXOPROPYL)-4-PIPERIDINYL)PYRROLO(2,1-F)(1,2,4)TRIAZIN-5-YL)PHENYL)-1,2,3,4-TETRAHYDRO-1-(1-METHYLETHYL)-2,4-DIOXO-3-(2-PYRIDINYL)-
Systematic Name English
INCB 081776 [WHO-DD]
Common Name English
Code System Code Type Description
FDA UNII
3OGC49TNT5
Created by admin on Sat Dec 16 14:08:27 GMT 2023 , Edited by admin on Sat Dec 16 14:08:27 GMT 2023
PRIMARY
PUBCHEM
130466316
Created by admin on Sat Dec 16 14:08:27 GMT 2023 , Edited by admin on Sat Dec 16 14:08:27 GMT 2023
PRIMARY
CAS
2135643-28-4
Created by admin on Sat Dec 16 14:08:27 GMT 2023 , Edited by admin on Sat Dec 16 14:08:27 GMT 2023
PRIMARY
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