N-[2-butoxy-3-[1-(4-fluorophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-butoxy-3-[1-(4-fluorophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[2-butoxy-3-[1-(4-fluorophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[2-butoxy-3-[[[[1-(4-fluorophenyl)ethylthio]amino]-oxomethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[2-butoxy-3-[1-(4-fluorophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[2-butoxy-3-[[1-(4-fluorophenyl)ethylthio]carbamoylamino]phenyl]-2-fluoro-benzamide Formula: C26H27F2N3O3S MolecularWeight: 499.572686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC=C1NC(=O)NSC(C)C2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCCCOC1=C(C=CC=C1NC(=O)NSC(C)C2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C26H27F2N3O3S/c1-3-4-16-34-24-22(29-25(32)20-8-5-6-9-21(20)28)10-7-11-23(24)30-26(33)31-35-17(2)18-12-14-19(27)15-13-18/h5-15,17H,3-4,16H2,1-2H3,(H,29,32)(H2,30,31,33)