2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]acetamide CAS Name: 2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-[ethyl-(3-fluoro-4-methoxy-benzyl)amino]acetamide Formula: C21H25FN2O2S MolecularWeight: 388.498803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C21H25FN2O2S/c1-4-12-27-20-9-7-6-8-18(20)23-21(25)15-24(5-2)14-16-10-11-19(26-3)17(22)13-16/h4,6-11,13H,1,5,12,14-15H2,2-3H3,(H,23,25)