KW-2581

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H36N2O4S
Molecular Weight	460.629
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC=C(C(=O)N(C(C)C)C(C)C)[C@@]1(C)CC[C@]3([H])C4=C(CC[C@@]23[H])C=C(OS(N)(=O)=O)C=C4

InChI

InChIKey=OCJKMKKDAMUFAY-APDHKMKFSA-N

InChI=1S/C25H36N2O4S/c1-15(2)27(16(3)4)24(28)23-11-10-22-21-8-6-17-14-18(31-32(26,29)30)7-9-19(17)20(21)12-13-25(22,23)5/h7,9,11,14-16,20-22H,6,8,10,12-13H2,1-5H3,(H2,26,29,30)/t20-,21-,22+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H36N2O4S
Molecular Weight	460.629
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:16:56 GMT 2023` Edited by `admin` on `Sat Dec 16 09:16:56 GMT 2023`
Record UNII	C38U4WZ67T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

KW-2581

Code

English

ESTRA-1,3,5(10),16-TETRAENE-17-CARBOXAMIDE, 3-((AMINOSULFONYL)OXY)-N,N-BIS(1-METHYLETHYL)-

Systematic Name

English

(3AS,3BS,9BS,11AS)-1-(BIS(PROPAN-2-YL)CARBAMOYL)-11A-METHYL-3H,3AH,3BH,4H,5H,9BH,10H,11H,11AH-CYCLOPENTA(A)PHENANTHREN-7-YL SULFAMATE

Systematic Name

English

3-((AMINOSULFONYL)OXY)-N,N-BIS(1-METHYLETHYL)ESTRA-1,3,5(10),16-TETRAENE-17-CARBOXAMIDE

Systematic Name

English

((8S,9S,13S,14S)-17-(DI(PROPAN-2-YL)CARBAMOYL)-13-METHYL-6,7,8,9,11,12,14,15-OCTAHYDROCYCLOPENTA(A)PHENANTHREN-3-YL) SULFAMATE

Systematic Name

English

KW2581

Code

English

Code System Code Type Description

FDA UNII

C38U4WZ67T

Created by admin on Sat Dec 16 09:16:56 GMT 2023 , Edited by admin on Sat Dec 16 09:16:56 GMT 2023

PRIMARY

CAS

284045-56-3

Created by admin on Sat Dec 16 09:16:56 GMT 2023 , Edited by admin on Sat Dec 16 09:16:56 GMT 2023

PRIMARY

PUBCHEM

9912111

Created by admin on Sat Dec 16 09:16:56 GMT 2023 , Edited by admin on Sat Dec 16 09:16:56 GMT 2023

PRIMARY

Related Record Type Details


					C38U4WZ67T

KW-2581

ACTIVE MOIETY