Viewing Compound With Structures

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Compound Report Overview

Compound Name: TICRYNAFEN
Compound Identifier: 701888
Mol Structure 2D: 701888
Molecular Weight: 331
Formula: C13 H8 Cl2 O4 S
Development Status: Withdrawn by FDA
SMILES: OC(=O)COc1ccc(C(=O)c2cccs2)c(Cl)c1Cl
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222422D 0 0.00000 0.00000 0^^ 20 21 0 0 0 999 V2000^ 10.1125 -0.8250 0.0000 S 0 0 0 0 0 0 0 0 0^ 9.4329 -1.0115 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.1531 -0.1216 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.4925 0.1318 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.0475 -0.4183 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.4208 -2.2375 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.3792 -1.6250 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.0125 -2.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.0750 -1.6250 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.3167 -2.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.0125 -1.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.9625 -1.6250 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.2000 -1.0125 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.2458 -1.6250 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.3000 -1.0292 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.8458 -0.4042 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.3792 -2.8667 0.0000 Cl 0 0 0 0 0 0 0 0 0^ 6.9500 -2.8583 0.0000 Cl 0 0 0 0 0 0 0 0 0^ 5.8958 -1.0125 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.8333 -1.6250 0.0000 O 0 0 0 0 0 0 0 0 0^ 3 4 2 0 0 0^ 4 5 1 0 0 0^ 5 2 2 0 0 0^ 2 1 1 0 0 0^ 1 3 1 0 0 0^ 8 7 2 0 0 0^ 9 7 1 0 0 0^ 10 8 1 0 0 0^ 11 7 1 0 0 0^ 12 15 1 0 0 0^ 13 19 1 0 0 0^ 14 12 1 0 0 0^ 15 11 2 0 0 0^ 16 13 2 0 0 0^ 17 8 1 0 0 0^ 18 10 1 0 0 0^ 19 14 1 0 0 0^ 20 13 1 0 0 0^ 12 10 2 0 0 0^ 9 6 2 0 0 0^ 9 2 1 0 0 0^M END^^
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