N-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamothioyl]-3-bromanyl-benzamide

Systemtic Name: N-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamothioyl]-3-bromanyl-benzamide Openeye Name: 3-bromo-N-[(9,10-dioxo-2-anthryl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[[(9,10-dioxo-2-anthracenyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(9,10-diketo-2-anthryl)thiocarbamoyl]benzamide Formula: C22H13BrN2O3S MolecularWeight: 465.31922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H13BrN2O3S/c23-13-5-3-4-12(10-13)21(28)25-22(29)24-14-8-9-17-18(11-14)20(27)16-7-2-1-6-15(16)19(17)26/h1-11H,(H2,24,25,28,29)