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

Systemtic Name: 2-[methyl-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioyl]amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[methyl-[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioyl]amino]benzamide CAS Name: 2-[methyl-[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[methyl-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioyl]amino]benzamide Traditional Name: N-benzyl-2-[methyl-[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoyl]amino]benzamide Formula: C29H25N3O2S MolecularWeight: 479.5927

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)C=CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)/C=C/C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H25N3O2S/c1-32(26-17-8-7-16-25(26)28(34)30-20-21-10-3-2-4-11-21)29(35)31-27(33)19-18-23-14-9-13-22-12-5-6-15-24(22)23/h2-19H,20H2,1H3,(H,30,34)(H,31,33,35)/b19-18+