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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H47N5O5S2
Molecular Weight 693.919
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of A-371191

SMILES

CN(C)CCCC[C@H](CSC1=CC=CC=C1)NC2=CC=C(C=C2[N+]([O-])=O)S(=O)(=O)NC(=O)C3=CC=C(C=C3)N4CCC5(CCCC5)CC4

InChI

InChIKey=OYHVBZRUUWRRKB-GDLZYMKVSA-N
InChI=1S/C36H47N5O5S2/c1-39(2)23-9-6-10-29(27-47-31-11-4-3-5-12-31)37-33-18-17-32(26-34(33)41(43)44)48(45,46)38-35(42)28-13-15-30(16-14-28)40-24-21-36(22-25-40)19-7-8-20-36/h3-5,11-18,26,29,37H,6-10,19-25,27H2,1-2H3,(H,38,42)/t29-/m1/s1

HIDE SMILES / InChI

Molecular Formula C36H47N5O5S2
Molecular Weight 693.919
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:34:43 GMT 2023
Edited
by admin
on Sat Dec 16 08:34:43 GMT 2023
Record UNII
XQ287TU15X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
A-371191
Common Name English
BENZAMIDE, 4-(8-AZASPIRO(4.5)DEC-8-YL)-N-((4-(((1R)-5-(DIMETHYLAMINO)-1-((PHENYLTHIO)METHYL)PENTYL)AMINO)-3-NITROPHENYL)SULFONYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
57654296
Created by admin on Sat Dec 16 08:34:43 GMT 2023 , Edited by admin on Sat Dec 16 08:34:43 GMT 2023
PRIMARY
FDA UNII
XQ287TU15X
Created by admin on Sat Dec 16 08:34:43 GMT 2023 , Edited by admin on Sat Dec 16 08:34:43 GMT 2023
PRIMARY
CAS
406228-58-8
Created by admin on Sat Dec 16 08:34:43 GMT 2023 , Edited by admin on Sat Dec 16 08:34:43 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY