1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-phenylsulfanyl-prop-2-en-1-one

Systemtic Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-phenylsulfanyl-prop-2-en-1-one Openeye Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-phenylsulfanyl-prop-2-en-1-one CAS Name: 1-[2-[(3-ethynylphenoxy)methyl]-4-morpholinyl]-3-(phenylthio)-2-propen-1-one IUPAC Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-phenylsulfanylprop-2-en-1-one Traditional Name: 1-[2-[(3-ethynylphenoxy)methyl]morpholino]-3-(phenylthio)prop-2-en-1-one Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)C=CSC3=CC=CC=C3

Isomeric SMILES

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)C=CSC3=CC=CC=C3

InChI

InChI=1S/C22H21NO3S/c1-2-18-7-6-8-19(15-18)26-17-20-16-23(12-13-25-20)22(24)11-14-27-21-9-4-3-5-10-21/h1,3-11,14-15,20H,12-13,16-17H2