N-cyclohexyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioyl-methyl-amino]benzamide

Systemtic Name: N-cyclohexyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioyl-methyl-amino]benzamide Openeye Name: N-cyclohexyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioyl-methyl-amino]benzamide CAS Name: N-cyclohexyl-2-[[[[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]-methylamino]benzamide IUPAC Name: N-cyclohexyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioyl-methylamino]benzamide Traditional Name: N-cyclohexyl-2-[[(E)-3-(4-fluorophenyl)acryloyl]thiocarbamoyl-methyl-amino]benzamide Formula: C24H26FN3O2S MolecularWeight: 439.545543

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C24H26FN3O2S/c1-28(24(31)27-22(29)16-13-17-11-14-18(25)15-12-17)21-10-6-5-9-20(21)23(30)26-19-7-3-2-4-8-19/h5-6,9-16,19H,2-4,7-8H2,1H3,(H,26,30)(H,27,29,31)/b16-13+