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Details

Stereochemistry ACHIRAL
Molecular Formula C26H27NOS
Molecular Weight 401.564
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-(2-(DIMETHYLAMINO)ETHOXY)-11-ETHYL-10-PHENYL DIBENZO(B,F)THIEPIN

SMILES

CCC1=C(C2=CC=CC=C2)C3=C(SC4=CC=CC=C14)C=C(OCCN(C)C)C=C3

InChI

InChIKey=XIXFFCIPCNOXSS-UHFFFAOYSA-N
InChI=1S/C26H27NOS/c1-4-21-22-12-8-9-13-24(22)29-25-18-20(28-17-16-27(2)3)14-15-23(25)26(21)19-10-6-5-7-11-19/h5-15,18H,4,16-17H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C26H27NOS
Molecular Weight 401.564
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 08:09:15 GMT 2023
Edited
by admin
on Sat Dec 16 08:09:15 GMT 2023
Record UNII
Y1I5UJA60F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-(2-(DIMETHYLAMINO)ETHOXY)-11-ETHYL-10-PHENYL DIBENZO(B,F)THIEPIN
Systematic Name English
DIBENZO(B,F)THIEPIN, 7-(2-(DIMETHYLAMINO)ETHOXY)-11-ETHYL-10-PHENYL-
Systematic Name English
ETHANAMINE, 2-((10-ETHYL-11-PHENYLDIBENZO(B,F)THIEPIN-3-YL)OXY)-N,N-DIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
55407
Created by admin on Sat Dec 16 08:09:15 GMT 2023 , Edited by admin on Sat Dec 16 08:09:15 GMT 2023
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EPA CompTox
DTXSID00235118
Created by admin on Sat Dec 16 08:09:15 GMT 2023 , Edited by admin on Sat Dec 16 08:09:15 GMT 2023
PRIMARY
FDA UNII
Y1I5UJA60F
Created by admin on Sat Dec 16 08:09:15 GMT 2023 , Edited by admin on Sat Dec 16 08:09:15 GMT 2023
PRIMARY
CAS
85850-77-7
Created by admin on Sat Dec 16 08:09:15 GMT 2023 , Edited by admin on Sat Dec 16 08:09:15 GMT 2023
PRIMARY