N-[1-(5-dodec-1-ynylthiophen-3-yl)-1,3-bis(oxidanyl)propan-2-yl]ethanamide

Systemtic Name: N-[1-(5-dodec-1-ynylthiophen-3-yl)-1,3-bis(oxidanyl)propan-2-yl]ethanamide Openeye Name: N-[2-(5-dodec-1-ynyl-3-thienyl)-2-hydroxy-1-(hydroxymethyl)ethyl]acetamide CAS Name: N-[1-(5-dodec-1-ynyl-3-thiophenyl)-1,3-dihydroxypropan-2-yl]acetamide IUPAC Name: N-[1-(5-dodec-1-ynylthiophen-3-yl)-1,3-dihydroxypropan-2-yl]acetamide Traditional Name: N-[2-(5-dodec-1-ynyl-3-thienyl)-2-hydroxy-1-methylol-ethyl]acetamide Formula: C21H33NO3S MolecularWeight: 379.55662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC(=CS1)C(C(CO)NC(=O)C)O

Isomeric SMILES

CCCCCCCCCCC#CC1=CC(=CS1)C(C(CO)NC(=O)C)O

InChI

InChI=1S/C21H33NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-19-14-18(16-26-19)21(25)20(15-23)22-17(2)24/h14,16,20-21,23,25H,3-11,15H2,1-2H3,(H,22,24)