ENCEQUIDAR, DES(CHROMOCARB)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H32N6O4
Molecular Weight	516.5915
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ENCEQUIDAR, DES(CHROMOCARB)-

Structure Search

SMILES

COC1=CC2=C(CN(CCC3=CC=C(C=C3)N4N=NC(=N4)C5=CC(OC)=C(OC)C=C5N)CC2)C=C1OC

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	516.5915
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 15:07:12 UTC 2023` Edited by `admin` on `Sat Dec 16 15:07:12 UTC 2023`
Record UNII	HV9AT0XM6D
Record Status	`Validated (UNII)`
Record Version

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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 Dec 16 15:07:12 UTC 2023 , Edited by admin on Sat Dec 16 15:07:12 UTC 2023

PRIMARY

CAS

849675-46-3

Created by admin on Sat Dec 16 15:07:12 UTC 2023 , Edited by admin on Sat Dec 16 15:07:12 UTC 2023

PRIMARY

PUBCHEM

67527073

Created by admin on Sat Dec 16 15:07:12 UTC 2023 , Edited by admin on Sat Dec 16 15:07:12 UTC 2023

PRIMARY

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ENCEQUIDAR

PARENT -> METABOLITE