N-ethyl-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioylamino]-N-naphthalen-1-yl-benzamide

Systemtic Name: N-ethyl-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioylamino]-N-naphthalen-1-yl-benzamide Openeye Name: N-ethyl-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioylamino]-N-(1-naphthyl)benzamide CAS Name: N-ethyl-4-[[[[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(1-naphthalenyl)benzamide IUPAC Name: N-ethyl-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioylamino]-N-naphthalen-1-ylbenzamide Traditional Name: N-ethyl-4-[[(E)-3-(4-fluorophenyl)acryloyl]thiocarbamoylamino]-N-(1-naphthyl)benzamide Formula: C29H24FN3O2S MolecularWeight: 497.583163

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)NC(=S)NC(=O)C=CC4=CC=C(C=C4)F

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)NC(=S)NC(=O)/C=C/C4=CC=C(C=C4)F

InChI

InChI=1S/C29H24FN3O2S/c1-2-33(26-9-5-7-21-6-3-4-8-25(21)26)28(35)22-13-17-24(18-14-22)31-29(36)32-27(34)19-12-20-10-15-23(30)16-11-20/h3-19H,2H2,1H3,(H2,31,32,34,36)/b19-12+