N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxo-ethyl]-4-fluoro-benzamide CAS Name: N-[2-[2-[(2-cyanophenyl)methylthio]ethylamino]-2-oxoethyl]-4-fluorobenzamide IUPAC Name: N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxoethyl]-4-fluorobenzamide Traditional Name: N-[2-[2-[(2-cyanobenzyl)thio]ethylamino]-2-keto-ethyl]-4-fluoro-benzamide Formula: C19H18FN3O2S MolecularWeight: 371.428523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)CNC(=O)C2=CC=C(C=C2)F)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)CNC(=O)C2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C19H18FN3O2S/c20-17-7-5-14(6-8-17)19(25)23-12-18(24)22-9-10-26-13-16-4-2-1-3-15(16)11-21/h1-8H,9-10,12-13H2,(H,22,24)(H,23,25)