N-[5,5-bis(oxidanylidene)-8-[[2-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]carbonylamino]dibenzothiophen-2-yl]-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide

Systemtic Name: N-[5,5-bis(oxidanylidene)-8-[[2-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]carbonylamino]dibenzothiophen-2-yl]-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Openeye Name: N-[5,5-dioxo-8-[[2-[[(E)-3-phenylprop-2-enoyl]amino]benzoyl]amino]dibenzothiophen-2-yl]-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide CAS Name: N-[5,5-dioxo-8-[[oxo-[2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]methyl]amino]-2-dibenzothiophenyl]-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]benzamide IUPAC Name: N-[5,5-dioxo-8-[[2-[[(E)-3-phenylprop-2-enoyl]amino]benzoyl]amino]dibenzothiophen-2-yl]-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Traditional Name: N-[5,5-diketo-8-[[2-[[(E)-3-phenylacryloyl]amino]benzoyl]amino]dibenzothiophen-2-yl]-2-[[(E)-3-phenylacryloyl]amino]benzamide Formula: C44H32N4O6S MolecularWeight: 744.81308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)S(=O)(=O)C5=C4C=C(C=C5)NC(=O)C6=CC=CC=C6NC(=O)C=CC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(S(=O)(=O)C5=C4C=C(C=C5)NC(=O)C6=CC=CC=C6NC(=O)/C=C/C7=CC=CC=C7)C=C3

InChI

InChI=1S/C44H32N4O6S/c49-41(25-19-29-11-3-1-4-12-29)47-37-17-9-7-15-33(37)43(51)45-31-21-23-39-35(27-31)36-28-32(22-24-40(36)55(39,53)54)46-44(52)34-16-8-10-18-38(34)48-42(50)26-20-30-13-5-2-6-14-30/h1-28H,(H,45,51)(H,46,52)(H,47,49)(H,48,50)/b25-19+,26-20+