UK-157147

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H24N2O7S
Molecular Weight	472.511
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1N=C(O[C@@H]2C3=CC(=CC=C3OC(C)(C)[C@@]2(C)O)S(=O)(=O)C4=CC(O)=CC=C4)C=CC1=O

InChI

InChIKey=MOZBVDKKWDXRGH-GGAORHGYSA-N

InChI=1S/C23H24N2O7S/c1-22(2)23(3,28)21(31-19-10-11-20(27)25(4)24-19)17-13-16(8-9-18(17)32-22)33(29,30)15-7-5-6-14(26)12-15/h5-13,21,26,28H,1-4H3/t21-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H24N2O7S
Molecular Weight	472.511
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:37:40 GMT 2023` Edited by `admin` on `Sat Dec 16 10:37:40 GMT 2023`
Record UNII	4MLV6V88TG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

UK-157147

Code

English

3(2H)-PYRIDAZINONE, 6-(((3S,4R)-3,4-DIHYDRO-3-HYDROXY-6-((3-HYDROXYPHENYL)SULFONYL)-2,2,3-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)OXY)-2-METHYL-

Systematic Name

English

3(2H)-PYRIDAZINONE, 6-((3,4-DIHYDRO-3-HYDROXY-6-((3-HYDROXYPHENYL)SULFONYL)-2,2,3-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)OXY)-2-METHYL-, (3S-TRANS)-

Systematic Name

English

6-(((3S,4R)-3,4-DIHYDRO-3-HYDROXY-6-((3-HYDROXYPHENYL)SULFONYL)-2,2,3-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)OXY)-2-METHYL-3(2H)-PYRIDAZINONE

Systematic Name

English

UK157147

Code

English

Code System Code Type Description

FDA UNII

4MLV6V88TG

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

PRIMARY

PUBCHEM

9869402

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

PRIMARY

CAS

162704-20-3

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

PRIMARY

Related Record Type Details


					4MLV6V88TG

UK-157147

ACTIVE MOIETY