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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H18F3N3O3S
Molecular Weight 437.435
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETOTHIOLUTAMIDE

SMILES

CC(=O)NC1=CC=C(SC[C@](C)(O)C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)C=C1

InChI

InChIKey=FEDHYHIWSREKGN-IBGZPJMESA-N
InChI=1S/C20H18F3N3O3S/c1-12(27)25-14-5-7-16(8-6-14)30-11-19(2,29)18(28)26-15-4-3-13(10-24)17(9-15)20(21,22)23/h3-9,29H,11H2,1-2H3,(H,25,27)(H,26,28)/t19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H18F3N3O3S
Molecular Weight 437.435
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
SW1TF3RGAH
Record Status Validated (UNII)
Record Version