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Details

Stereochemistry ACHIRAL
Molecular Formula C12H7ClF6N4S
Molecular Weight 388.719
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of THIADIFLUOR

SMILES

CN=C1SC(=NC(F)(F)F)C(=NC(F)(F)F)N1C2=CC=C(Cl)C=C2

InChI

InChIKey=HBLSGPQATABNRY-IPEGEUOLSA-N
InChI=1S/C12H7ClF6N4S/c1-20-10-23(7-4-2-6(13)3-5-7)8(21-11(14,15)16)9(24-10)22-12(17,18)19/h2-5H,1H3/b20-10+,21-8+,22-9-

HIDE SMILES / InChI

Molecular Formula C12H7ClF6N4S
Molecular Weight 388.719
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 3
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
36NI446PIZ
Record Status Validated (UNII)
Record Version