2-bromanyl-N-[1-[[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[[2-(3-fluoroanilino)-2-oxo-ethyl]-methyl-carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[[2-(3-fluoroanilino)-2-keto-ethyl]-methyl-carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H23BrFN3O3S MolecularWeight: 496.393023

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C21H23BrFN3O3S/c1-26(13-19(27)24-15-7-5-6-14(23)12-15)21(29)18(10-11-30-2)25-20(28)16-8-3-4-9-17(16)22/h3-9,12,18H,10-11,13H2,1-2H3,(H,24,27)(H,25,28)