N-[9,10-bis(oxidanylidene)anthracen-2-yl]-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(9,10-diketo-2-anthryl)-3-(p-tolylthio)propionamide Formula: C24H19NO3S MolecularWeight: 401.47756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H19NO3S/c1-15-6-9-17(10-7-15)29-13-12-22(26)25-16-8-11-20-21(14-16)24(28)19-5-3-2-4-18(19)23(20)27/h2-11,14H,12-13H2,1H3,(H,25,26)