CHEBI:102783 - LSM-14129

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ChEBI Name LSM-14129
ChEBI ID CHEBI:102783
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H33N3O5S
Net Charge 0
Average Mass 547.667
Monoisotopic Mass 547.21409
InChI InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m1/s1
InChIKey RWOMJVAVZPFCIF-QLVXXPONSA-N
SMILES C[C@@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@H]1CN(C)S(=O)(=O)C4=CC=CC(=C4)C#N)[C@H](C)CO
ChEBI Ontology
Outgoing LSM-14129 (CHEBI:102783) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-14129 LINCS
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