N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide Openeye Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazino]-2-oxo-ethyl]-2-fluoro-benzamide CAS Name: N-[2-[[(4-butylanilino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-2-fluorobenzamide IUPAC Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxoethyl]-2-fluorobenzamide Traditional Name: N-[2-[N'-[(4-butylphenyl)thiocarbamoyl]hydrazino]-2-keto-ethyl]-2-fluoro-benzamide Formula: C20H23FN4O2S MolecularWeight: 402.485623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC(=O)C2=CC=CC=C2F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C20H23FN4O2S/c1-2-3-6-14-9-11-15(12-10-14)23-20(28)25-24-18(26)13-22-19(27)16-7-4-5-8-17(16)21/h4-5,7-12H,2-3,6,13H2,1H3,(H,22,27)(H,24,26)(H2,23,25,28)