N-(4-phenylazanylphenyl)-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide

Systemtic Name: N-(4-phenylazanylphenyl)-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide Openeye Name: N-(4-anilinophenyl)-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide CAS Name: N-(4-anilinophenyl)-2-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-anilinophenyl)-2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzamide Traditional Name: N-(4-anilinophenyl)-2-[[(E)-3-phenylacryloyl]thiocarbamoylamino]benzamide Formula: C29H24N4O2S MolecularWeight: 492.59146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

InChI

InChI=1S/C29H24N4O2S/c34-27(20-15-21-9-3-1-4-10-21)33-29(36)32-26-14-8-7-13-25(26)28(35)31-24-18-16-23(17-19-24)30-22-11-5-2-6-12-22/h1-20,30H,(H,31,35)(H2,32,33,34,36)/b20-15+