U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C28H42N8O3
Molecular Weight 538.6849
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Ethyl-3-[[3-methoxy-4-[4-(1-piperazinyl)-1-piperidinyl]phenyl]amino]-5-[(tetrahydro-2H-pyran-4-yl)amino]-2-pyrazinecarboxamide

SMILES

CCC1=C(NC2CCOCC2)N=C(NC3=CC(OC)=C(C=C3)N4CCC(CC4)N5CCNCC5)C(=N1)C(N)=O

InChI

InChIKey=HWWOWSDXQIZWHB-UHFFFAOYSA-N
InChI=1S/C28H42N8O3/c1-3-22-27(31-19-8-16-39-17-9-19)34-28(25(33-22)26(29)37)32-20-4-5-23(24(18-20)38-2)36-12-6-21(7-13-36)35-14-10-30-11-15-35/h4-5,18-19,21,30H,3,6-17H2,1-2H3,(H2,29,37)(H2,31,32,34)

HIDE SMILES / InChI

Molecular Formula C28H42N8O3
Molecular Weight 538.6849
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 19:53:33 GMT 2023
Edited
by admin
on Sat Dec 16 19:53:33 GMT 2023
Record UNII
984N3BL9P5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-Ethyl-3-[[3-methoxy-4-[4-(1-piperazinyl)-1-piperidinyl]phenyl]amino]-5-[(tetrahydro-2H-pyran-4-yl)amino]-2-pyrazinecarboxamide
Systematic Name English
2-Pyrazinecarboxamide, 6-ethyl-3-[[3-methoxy-4-[4-(1-piperazinyl)-1-piperidinyl]phenyl]amino]-5-[(tetrahydro-2H-pyran-4-yl)amino]-
Systematic Name English
Code System Code Type Description
FDA UNII
984N3BL9P5
Created by admin on Sat Dec 16 19:53:33 GMT 2023 , Edited by admin on Sat Dec 16 19:53:33 GMT 2023
PRIMARY
PUBCHEM
166626288
Created by admin on Sat Dec 16 19:53:33 GMT 2023 , Edited by admin on Sat Dec 16 19:53:33 GMT 2023
PRIMARY
CAS
1373410-40-2
Created by admin on Sat Dec 16 19:53:33 GMT 2023 , Edited by admin on Sat Dec 16 19:53:33 GMT 2023
PRIMARY