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Details

Stereochemistry ACHIRAL
Molecular Formula C29H28F3N5O.2ClH
Molecular Weight 592.483
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUDOTERB DIHYDROCHLORIDE

SMILES

Cl.Cl.CC1=C(CN2CCN(CC2)C3=CC(=CC=C3)C(F)(F)F)C=C(N1NC(=O)C4=CC=NC=C4)C5=CC=CC=C5

InChI

InChIKey=FVWAUSWEYDJAAM-UHFFFAOYSA-N
InChI=1S/C29H28F3N5O.2ClH/c1-21-24(20-35-14-16-36(17-15-35)26-9-5-8-25(19-26)29(30,31)32)18-27(22-6-3-2-4-7-22)37(21)34-28(38)23-10-12-33-13-11-23;;/h2-13,18-19H,14-17,20H2,1H3,(H,34,38);2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C29H28F3N5O
Molecular Weight 519.5607
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
5DRV9UU348
Record Status Validated (UNII)
Record Version