Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: ICX5609118
Compound Identifier: 708076
Mol Structure 2D: 708076
Molecular Weight: 309
Formula: C16 H27 N3 O S
Development Status: Laboratory Testing
SMILES: CCC(C)C(NCC(N)CS)C(=O)NCc1ccccc1
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100221412D 0 0.00000 0.00000 0^^ 21 21 0 0 0 999 V2000^ 3.4417 -5.8792 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.0167 -5.8792 0.0000 N 0 0 0 0 0 0 0 0 0^ 2.7292 -6.2917 0.0000 C 0 0 1 0 0 0 0 0 0^ 4.1542 -6.2917 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.4375 -5.0542 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.3042 -6.2917 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.8667 -5.8792 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5917 -5.8792 0.0000 C 0 0 1 0 0 0 0 0 0^ 2.7292 -7.1167 0.0000 C 0 0 3 0 0 0 0 0 0^ -0.1208 -6.2917 0.0000 N 0 0 0 0 0 0 0 0 0^ -0.1250 -4.6417 0.0000 S 0 0 0 0 0 0 0 0 0^ 5.5792 -6.2917 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5917 -5.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4417 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.0083 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.5750 -7.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.2917 -5.8792 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4417 -8.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.0042 -6.2917 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.2875 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.0042 -7.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 3 1 0 0 0^ 3 1 1 0 0 0^ 4 1 1 0 0 0^ 5 1 2 0 0 0^ 6 2 1 0 0 0^ 7 4 1 0 0 0^ 8 6 1 0 0 0^ 3 9 1 6 0 0^ 10 8 1 0 0 0^ 11 13 1 0 0 0^ 12 7 1 0 0 0^ 8 13 1 1 0 0^ 14 9 1 0 0 0^ 15 9 1 0 0 0^ 16 12 2 0 0 0^ 17 12 1 0 0 0^ 18 14 1 0 0 0^ 19 17 2 0 0 0^ 20 16 1 0 0 0^ 21 19 1 0 0 0^ 20 21 2 0 0 0^M END^^
Structure View
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