4-tert-butyl-N-[3-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-[(4-fluorophenyl)carbamothioyl]hydrazino]-3-oxo-propyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazo]-3-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-3-oxopropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[N'-[(4-fluorophenyl)thiocarbamoyl]hydrazino]-3-keto-propyl]benzamide Formula: C21H25FN4O2S MolecularWeight: 416.512203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NNC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C21H25FN4O2S/c1-21(2,3)15-6-4-14(5-7-15)19(28)23-13-12-18(27)25-26-20(29)24-17-10-8-16(22)9-11-17/h4-11H,12-13H2,1-3H3,(H,23,28)(H,25,27)(H2,24,26,29)