N-[2-[2-(cyanomethylsulfanyl)ethanoylamino]ethyl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-[2-[2-(cyanomethylsulfanyl)ethanoylamino]ethyl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[2-[[2-(cyanomethylsulfanyl)acetyl]amino]ethyl]-3-fluoro-4-methyl-benzamide CAS Name: N-[2-[[2-(cyanomethylthio)-1-oxoethyl]amino]ethyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[2-[[2-(cyanomethylsulfanyl)acetyl]amino]ethyl]-3-fluoro-4-methylbenzamide Traditional Name: N-[2-[[2-(cyanomethylthio)acetyl]amino]ethyl]-3-fluoro-4-methyl-benzamide Formula: C14H16FN3O2S MolecularWeight: 309.359143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCNC(=O)CSCC#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCNC(=O)CSCC#N)F

InChI

InChI=1S/C14H16FN3O2S/c1-10-2-3-11(8-12(10)15)14(20)18-6-5-17-13(19)9-21-7-4-16/h2-3,8H,5-7,9H2,1H3,(H,17,19)(H,18,20)