N-[6-(phenylcarbonylcarbamothioylamino)hexylcarbamothioyl]benzamide

Systemtic Name: N-[6-(phenylcarbonylcarbamothioylamino)hexylcarbamothioyl]benzamide Openeye Name: N-[6-(benzoylcarbamothioylamino)hexylcarbamothioyl]benzamide CAS Name: N-[[6-[[benzamido(sulfanylidene)methyl]amino]hexylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[6-(benzoylcarbamothioylamino)hexylcarbamothioyl]benzamide Traditional Name: N-[6-(benzoylthiocarbamoylamino)hexylthiocarbamoyl]benzamide Formula: C22H26N4O2S2 MolecularWeight: 442.59744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=S)NCCCCCCNC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)NCCCCCCNC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26N4O2S2/c27-19(17-11-5-3-6-12-17)25-21(29)23-15-9-1-2-10-16-24-22(30)26-20(28)18-13-7-4-8-14-18/h3-8,11-14H,1-2,9-10,15-16H2,(H2,23,25,27,29)(H2,24,26,28,30)