N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C22H27FN2O3S MolecularWeight: 418.524783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C(C)SCC(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C(C)SCC(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C22H27FN2O3S/c1-5-25(13-17-8-11-20(28-4)19(23)12-17)22(27)16(3)29-14-21(26)24-18-9-6-15(2)7-10-18/h6-12,16H,5,13-14H2,1-4H3,(H,24,26)