2-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]-N-(4-phenylazanylphenyl)benzamide

Systemtic Name: 2-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]-N-(4-phenylazanylphenyl)benzamide Openeye Name: N-(4-anilinophenyl)-2-[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioylamino]benzamide CAS Name: N-(4-anilinophenyl)-2-[[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-anilinophenyl)-2-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]benzamide Traditional Name: N-(4-anilinophenyl)-2-[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoylamino]benzamide Formula: C33H26N4O2S MolecularWeight: 542.65014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC(=S)NC(=O)C=CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC(=S)NC(=O)/C=C/C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C33H26N4O2S/c38-31(22-17-24-11-8-10-23-9-4-5-14-28(23)24)37-33(40)36-30-16-7-6-15-29(30)32(39)35-27-20-18-26(19-21-27)34-25-12-2-1-3-13-25/h1-22,34H,(H,35,39)(H2,36,37,38,40)/b22-17+