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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H12F3NO6S
Molecular Weight 403.33
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4,10-DIHYDRO-5,5-DIOXIDO-10-OXO(1)BENZOTHIEPINO(4,3-B)FURAN-9-YL)-3,3,3-TRIFLUORO-2-HYDROXY-2-METHYLPROPANAMIDE, (2S)-

SMILES

C[C@](O)(C(=O)NC1=C2C(=CC=C1)S(=O)(=O)CC3=C(OC=C3)C2=O)C(F)(F)F

InChI

InChIKey=YVEDUSQAAOTGFM-HNNXBMFYSA-N
InChI=1S/C16H12F3NO6S/c1-15(23,16(17,18)19)14(22)20-9-3-2-4-10-11(9)12(21)13-8(5-6-26-13)7-27(10,24)25/h2-6,23H,7H2,1H3,(H,20,22)/t15-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
N-(4,10-DIHYDRO-5,5-DIOXIDO-10-OXO(1)BENZOTHIEPINO(4,3-B)FURAN-9-YL)-3,3,3-TRIFLUORO-2-HYDROXY-2-METHYLPROPANAMIDE, (2S)-
Systematic Name English
KW-7158 METABOLITE M1
Common Name English
PROPANAMIDE, N-(4,10-DIHYDRO-5,5-DIOXIDO-10-OXO(1)BENZOTHIEPINO(4,3-B)FURAN-9-YL)-3,3,3-TRIFLUORO-2-HYDROXY-2-METHYL-, (2S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
118796485
Created by admin on Sat Dec 16 09:08:43 GMT 2023 , Edited by admin on Sat Dec 16 09:08:43 GMT 2023
PRIMARY
CAS
1392269-18-9
Created by admin on Sat Dec 16 09:08:43 GMT 2023 , Edited by admin on Sat Dec 16 09:08:43 GMT 2023
PRIMARY
FDA UNII
MQ8HCI2333
Created by admin on Sat Dec 16 09:08:43 GMT 2023 , Edited by admin on Sat Dec 16 09:08:43 GMT 2023
PRIMARY