N-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamothioyl]-4-chloranyl-benzamide

Systemtic Name: N-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamothioyl]-4-chloranyl-benzamide Openeye Name: 4-chloro-N-[(9,10-dioxo-2-anthryl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[[(9,10-dioxo-2-anthracenyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(9,10-diketo-2-anthryl)thiocarbamoyl]benzamide Formula: C22H13ClN2O3S MolecularWeight: 420.86822

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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=C(C=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H13ClN2O3S/c23-13-7-5-12(6-8-13)21(28)25-22(29)24-14-9-10-17-18(11-14)20(27)16-4-2-1-3-15(16)19(17)26/h1-11H,(H2,24,25,28,29)