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Details

Stereochemistry RACEMIC
Molecular Formula C11H12ClF3N4O5S3
Molecular Weight 468.88
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-nitroso-polythiazide

SMILES

CN1C(CSCC(F)(F)F)N(N=O)C2=CC(Cl)=C(C=C2S1(=O)=O)S(N)(=O)=O

InChI

InChIKey=XZHICZSPCJIQDH-UHFFFAOYSA-N
InChI=1S/C11H12ClF3N4O5S3/c1-18-10(4-25-5-11(13,14)15)19(17-20)7-2-6(12)8(26(16,21)22)3-9(7)27(18,23)24/h2-3,10H,4-5H2,1H3,(H2,16,21,22)

HIDE SMILES / InChI

Molecular Formula C11H12ClF3N4O5S3
Molecular Weight 468.88
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
452M5M8T7W
Record Status Validated (UNII)
Record Version