N-[3-chloranyl-9,10-bis(oxidanylidene)anthracen-2-yl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[3-chloranyl-9,10-bis(oxidanylidene)anthracen-2-yl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(3-chloro-9,10-dioxo-2-anthryl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(3-chloro-9,10-dioxo-2-anthracenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(3-chloro-9,10-dioxoanthracen-2-yl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(3-chloro-9,10-diketo-2-anthryl)-2-(quinazolin-4-ylthio)acetamide Formula: C24H14ClN3O3S MolecularWeight: 459.90426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C=C3C2=O)Cl)NC(=O)CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C=C3C2=O)Cl)NC(=O)CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C24H14ClN3O3S/c25-18-9-16-17(23(31)14-6-2-1-5-13(14)22(16)30)10-20(18)28-21(29)11-32-24-15-7-3-4-8-19(15)26-12-27-24/h1-10,12H,11H2,(H,28,29)