N-[(2-bromophenyl)methyl]-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-methyl-propanamide

Systemtic Name: N-[(2-bromophenyl)methyl]-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-methyl-propanamide Openeye Name: N-[(2-bromophenyl)methyl]-2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-N-methyl-propanamide CAS Name: N-[(2-bromophenyl)methyl]-2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-N-methylpropanamide IUPAC Name: N-[(2-bromophenyl)methyl]-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-N-methylpropanamide Traditional Name: N-(2-bromobenzyl)-2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-N-methyl-propionamide Formula: C19H20BrFN2O2S MolecularWeight: 439.341703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=CC=C1Br)SCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)N(C)CC1=CC=CC=C1Br)SCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C19H20BrFN2O2S/c1-13(19(25)23(2)11-14-5-3-4-6-17(14)20)26-12-18(24)22-16-9-7-15(21)8-10-16/h3-10,13H,11-12H2,1-2H3,(H,22,24)