N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[(tert-butylcarbamothioylamino)carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[(2S)-1-[[(tert-butylamino)-sulfanylidenemethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-[(tert-butylthiocarbamoylamino)carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C17H25FN4O2S MolecularWeight: 368.469403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=S)NC(C)(C)C)NC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C)[C@@H](C(=O)NNC(=S)NC(C)(C)C)NC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C17H25FN4O2S/c1-10(2)13(15(24)21-22-16(25)20-17(3,4)5)19-14(23)11-6-8-12(18)9-7-11/h6-10,13H,1-5H3,(H,19,23)(H,21,24)(H2,20,22,25)/t13-/m0/s1