N-[4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]-2-phenylmethoxy-phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]-2-phenylmethoxy-phenyl]-2-fluoranyl-benzamide Openeye Name: N-[2-benzyloxy-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[[1-(4-cyanophenyl)ethylthio]amino]-oxomethyl]amino]-2-phenylmethoxyphenyl]-2-fluorobenzamide IUPAC Name: N-[4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]-2-phenylmethoxyphenyl]-2-fluorobenzamide Traditional Name: N-[2-benzoxy-4-[[1-(4-cyanophenyl)ethylthio]carbamoylamino]phenyl]-2-fluoro-benzamide Formula: C30H25FN4O3S MolecularWeight: 540.607903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)SNC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3F)OCC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)SNC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3F)OCC4=CC=CC=C4

InChI

InChI=1S/C30H25FN4O3S/c1-20(23-13-11-21(18-32)12-14-23)39-35-30(37)33-24-15-16-27(34-29(36)25-9-5-6-10-26(25)31)28(17-24)38-19-22-7-3-2-4-8-22/h2-17,20H,19H2,1H3,(H,34,36)(H2,33,35,37)