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Details

Stereochemistry ACHIRAL
Molecular Formula C28H27Cl2N3O4
Molecular Weight 540.438
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TERN-101

SMILES

CN1C=C(C(O)=O)C2=C1C=C(C=C2)N3CCC(CC3)OCC4=C(ON=C4C5=C(Cl)C=CC=C5Cl)C6CC6

InChI

InChIKey=RPVDFHPBGBMWID-UHFFFAOYSA-N
InChI=1S/C28H27Cl2N3O4/c1-32-14-20(28(34)35)19-8-7-17(13-24(19)32)33-11-9-18(10-12-33)36-15-21-26(31-37-27(21)16-5-6-16)25-22(29)3-2-4-23(25)30/h2-4,7-8,13-14,16,18H,5-6,9-12,15H2,1H3,(H,34,35)

HIDE SMILES / InChI

Molecular Formula C28H27Cl2N3O4
Molecular Weight 540.438
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
VVA2ZDV3LX
Record Status Validated (UNII)
Record Version