N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-(9,10-dioxo-2-anthryl)acetamide CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]-N-(9,10-dioxo-2-anthracenyl)acetamide IUPAC Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(9,10-dioxoanthracen-2-yl)acetamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C27H20N2O3S MolecularWeight: 452.5243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H20N2O3S/c1-15-6-5-9-18-16(2)12-24(29-25(15)18)33-14-23(30)28-17-10-11-21-22(13-17)27(32)20-8-4-3-7-19(20)26(21)31/h3-13H,14H2,1-2H3,(H,28,30)