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Details

Stereochemistry ACHIRAL
Molecular Formula C21H25N3O2S
Molecular Weight 383.507
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-(4-OXO-4-(2-THIENYL)BUTYL)-1-PHENYL-1,3,8-TRIAZASPIRO(4.5)DECAN-4-ONE

SMILES

O=C(CCCN1CCC2(CC1)N(CNC2=O)C3=CC=CC=C3)C4=CC=CS4

InChI

InChIKey=GGPNVJSQHATEIZ-UHFFFAOYSA-N
InChI=1S/C21H25N3O2S/c25-18(19-9-5-15-27-19)8-4-12-23-13-10-21(11-14-23)20(26)22-16-24(21)17-6-2-1-3-7-17/h1-3,5-7,9,15H,4,8,10-14,16H2,(H,22,26)

HIDE SMILES / InChI

Molecular Formula C21H25N3O2S
Molecular Weight 383.507
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 12:56:16 GMT 2023
Edited
by admin
on Sat Dec 16 12:56:16 GMT 2023
Record UNII
C1RRP6D1TX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-(4-OXO-4-(2-THIENYL)BUTYL)-1-PHENYL-1,3,8-TRIAZASPIRO(4.5)DECAN-4-ONE
Systematic Name English
1,3,8-TRIAZASPIRO(4.5)DECAN-4-ONE, 1-PHENYL-8-(3-(2-THENOYL)PROPYL)-
Systematic Name English
1,3,8-TRIAZASPIRO(4.5)DECAN-4-ONE, 8-(4-OXO-4-(2-THIENYL)BUTYL)-1-PHENYL-
Systematic Name English
NSC-167711
Code English
Code System Code Type Description
EPA CompTox
DTXSID80147063
Created by admin on Sat Dec 16 12:56:16 GMT 2023 , Edited by admin on Sat Dec 16 12:56:16 GMT 2023
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FDA UNII
C1RRP6D1TX
Created by admin on Sat Dec 16 12:56:16 GMT 2023 , Edited by admin on Sat Dec 16 12:56:16 GMT 2023
PRIMARY
CAS
1053-15-2
Created by admin on Sat Dec 16 12:56:16 GMT 2023 , Edited by admin on Sat Dec 16 12:56:16 GMT 2023
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NSC
167711
Created by admin on Sat Dec 16 12:56:16 GMT 2023 , Edited by admin on Sat Dec 16 12:56:16 GMT 2023
PRIMARY
PUBCHEM
98812
Created by admin on Sat Dec 16 12:56:16 GMT 2023 , Edited by admin on Sat Dec 16 12:56:16 GMT 2023
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