L-760735F HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H28F7N5O2.ClH
Molecular Weight	611.983
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.C[C@@H](O[C@H]1OCCN(CC2=C(CN(C)C)N=NN2)[C@H]1C3=CC=C(F)C=C3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChIKey=VZBKOBSSEVXFNF-QIRDZIKRSA-N

InChI=1S/C26H28F7N5O2.ClH/c1-15(17-10-18(25(28,29)30)12-19(11-17)26(31,32)33)40-24-23(16-4-6-20(27)7-5-16)38(8-9-39-24)14-22-21(13-37(2)3)34-36-35-22;/h4-7,10-12,15,23-24H,8-9,13-14H2,1-3H3,(H,34,35,36);1H/t15-,23+,24-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C26H28F7N5O2
Molecular Weight	575.5216
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:51:46 UTC 2023` Edited by `admin` on `Fri Dec 15 15:51:46 UTC 2023`
Record UNII	E4C3XGZ4U7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-760735F HYDROCHLORIDE

Code

English

1H-1,2,3-TRIAZOLE-4-METHANAMINE, 5-(((2R,3S)-2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)-4-MORPHOLINYL)METHYL)-N,N-DIMETHYL-, HYDROCHLORIDE (1:1)

Systematic Name

English

5-((2-(1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)-4-MORPHOLINYL)METHYL)-N,N-DIMETHYL-1H-1,2,3-TRIAZOLE-4-METHANAMINE HYDROCHLORIDE, 2R-(2AR*,3A)

Common Name

English

1H-1,2,3-TRIAZOLE-4-METHANAMINE, 5-(((2R,3S)-2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)-4-MORPHOLINYL)METHYL)-N,N-DIMETHYL-, MONOHYDROCHLORIDE

Common Name

English

Code System Code Type Description

PUBCHEM

9809076

Created by admin on Fri Dec 15 15:51:46 UTC 2023 , Edited by admin on Fri Dec 15 15:51:46 UTC 2023

PRIMARY

EPA CompTox

DTXSID30430977

Created by admin on Fri Dec 15 15:51:46 UTC 2023 , Edited by admin on Fri Dec 15 15:51:46 UTC 2023

PRIMARY

FDA UNII

E4C3XGZ4U7

Created by admin on Fri Dec 15 15:51:46 UTC 2023 , Edited by admin on Fri Dec 15 15:51:46 UTC 2023

PRIMARY

CAS

188923-01-5

Created by admin on Fri Dec 15 15:51:46 UTC 2023 , Edited by admin on Fri Dec 15 15:51:46 UTC 2023

PRIMARY

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