N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-(2-pyrimidylthio)propionamide Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)SC4=NC=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)SC4=NC=CC=N4

InChI

InChI=1S/C21H15N3O3S/c1-12(28-21-22-9-4-10-23-21)20(27)24-13-7-8-16-17(11-13)19(26)15-6-3-2-5-14(15)18(16)25/h2-12H,1H3,(H,24,27)