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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H37N5O4S.C6H6O3S
Molecular Weight 697.865
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MV-061194 besylate

SMILES

OS(=O)(=O)C1=CC=CC=C1.CC[C@@H]2OCC(=O)[C@H]2NC(=O)C3(CCCCC3)NC(=O)C4=CC=C(C=C4)C5=CSC(=N5)N6CCN(C)CC6

InChI

InChIKey=IYSLJPDQSSCHTA-KZDWWKKTSA-N
InChI=1S/C28H37N5O4S.C6H6O3S/c1-3-23-24(22(34)17-37-23)30-26(36)28(11-5-4-6-12-28)31-25(35)20-9-7-19(8-10-20)21-18-38-27(29-21)33-15-13-32(2)14-16-33;7-10(8,9)6-4-2-1-3-5-6/h7-10,18,23-24H,3-6,11-17H2,1-2H3,(H,30,36)(H,31,35);1-5H,(H,7,8,9)/t23-,24+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H6O3S
Molecular Weight 158.175
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C28H37N5O4S
Molecular Weight 539.689
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:21:34 GMT 2025
Edited
by admin
on Wed Apr 02 20:21:34 GMT 2025
Record UNII
SG6CM2VV48
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MV-061194 besylate
Code English
MV061194 besylate
Preferred Name English
L-erythro-2-Hexulose, 1,4-anhydro-3,5,6-trideoxy-3-[[[1-[[4-[2-(4-methyl-1-piperazinyl)-4-thiazolyl]benzoyl]amino]cyclohexyl]carbonyl]amino]-, benzene sulphonic acid
Systematic Name English
Code System Code Type Description
FDA UNII
SG6CM2VV48
Created by admin on Wed Apr 02 20:21:34 GMT 2025 , Edited by admin on Wed Apr 02 20:21:34 GMT 2025
PRIMARY
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