N-cyclohexyl-2-[methyl-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioyl]amino]benzamide

Systemtic Name: N-cyclohexyl-2-[methyl-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioyl]amino]benzamide Openeye Name: N-cyclohexyl-2-[methyl-[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioyl]amino]benzamide CAS Name: N-cyclohexyl-2-[methyl-[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[methyl-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioyl]amino]benzamide Traditional Name: N-cyclohexyl-2-[methyl-[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoyl]amino]benzamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)C=CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)/C=C/C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H29N3O2S/c1-31(25-17-8-7-16-24(25)27(33)29-22-13-3-2-4-14-22)28(34)30-26(32)19-18-21-12-9-11-20-10-5-6-15-23(20)21/h5-12,15-19,22H,2-4,13-14H2,1H3,(H,29,33)(H,30,32,34)/b19-18+