3-bromanyl-N-[4-[(3-bromophenyl)carbonylcarbamothioyl]piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 3-bromanyl-N-[4-[(3-bromophenyl)carbonylcarbamothioyl]piperazin-1-yl]carbothioyl-benzamide Openeye Name: 3-bromo-N-[4-[(3-bromobenzoyl)carbamothioyl]piperazine-1-carbothioyl]benzamide CAS Name: 3-bromo-N-[[4-[[[(3-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[4-[(3-bromobenzoyl)carbamothioyl]piperazine-1-carbothioyl]benzamide Traditional Name: 3-bromo-N-[4-[(3-bromobenzoyl)thiocarbamoyl]piperazine-1-carbothioyl]benzamide Formula: C20H18Br2N4O2S2 MolecularWeight: 570.32052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NC(=O)C2=CC(=CC=C2)Br)C(=S)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C(=S)NC(=O)C2=CC(=CC=C2)Br)C(=S)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18Br2N4O2S2/c21-15-5-1-3-13(11-15)17(27)23-19(29)25-7-9-26(10-8-25)20(30)24-18(28)14-4-2-6-16(22)12-14/h1-6,11-12H,7-10H2,(H,23,27,29)(H,24,28,30)