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Details

Stereochemistry ACHIRAL
Molecular Formula C28H32N6O4
Molecular Weight 516.5925
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ENCEQUIDAR, DES(CHROMOCARB)-

SMILES

COc1cc2CCN(CCc3ccc(cc3)-n4nc(-c5cc(c(cc5N)OC)OC)nn4)Cc2cc1OC

InChI

InChIKey=AXPBUYJDGMRABC-UHFFFAOYSA-N
InChI=1S/C28H32N6O4/c1-35-24-13-19-10-12-33(17-20(19)14-25(24)36-2)11-9-18-5-7-21(8-6-18)34-31-28(30-32-34)22-15-26(37-3)27(38-4)16-23(22)29/h5-8,13-16H,9-12,17,29H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C28H32N6O4
Molecular Weight 516.5925
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 Jun 26 16:01:17 UTC 2021
Edited
by admin
on Sat Jun 26 16:01:17 UTC 2021
Record UNII
HV9AT0XM6D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENCEQUIDAR, DES(CHROMOCARB)-
Common Name English
BENZENAMINE, 2-(2-(4-(2-(3,4-DIHYDRO-6,7-DIMETHOXY-2(1H)-ISOQUINOLINYL)ETHYL)PHENYL)-2H-TETRAZOL-5-YL)-4,5-DIMETHOXY-
Systematic Name English
ENCEQUIDAR METABOLITE M1
Common Name English
2-(2-(4-(2-(3,4-DIHYDRO-6,7-DIMETHOXY-2(1H)-ISOQUINOLINYL)ETHYL)PHENYL)-2H-TETRAZOL-5-YL)-4,5-DIMETHOXYBENZENAMINE
Systematic Name English
Code System Code Type Description
FDA UNII
HV9AT0XM6D
Created by admin on Sat Jun 26 16:01:17 UTC 2021 , Edited by admin on Sat Jun 26 16:01:17 UTC 2021
PRIMARY
CAS
849675-46-3
Created by admin on Sat Jun 26 16:01:17 UTC 2021 , Edited by admin on Sat Jun 26 16:01:17 UTC 2021
PRIMARY
PUBCHEM
67527073
Created by admin on Sat Jun 26 16:01:17 UTC 2021 , Edited by admin on Sat Jun 26 16:01:17 UTC 2021
PRIMARY
Related Record Type Details
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