1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-5-thiophen-2-yl-pentan-1-one

Systemtic Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-5-thiophen-2-yl-pentan-1-one Openeye Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-5-(2-thienyl)pentan-1-one CAS Name: 1-[2-[(3-ethynylphenoxy)methyl]-4-morpholinyl]-5-thiophen-2-yl-1-pentanone IUPAC Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-5-thiophen-2-ylpentan-1-one Traditional Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholino]-5-(2-thienyl)pentan-1-one Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)CCCCC3=CC=CS3

Isomeric SMILES

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)CCCCC3=CC=CS3

InChI

InChI=1S/C22H25NO3S/c1-2-18-7-5-8-19(15-18)26-17-20-16-23(12-13-25-20)22(24)11-4-3-9-21-10-6-14-27-21/h1,5-8,10,14-15,20H,3-4,9,11-13,16-17H2