N-[9,10-bis(oxidanylidene)-4-phenylsulfanyl-anthracen-1-yl]-2-methyl-benzamide

Systemtic Name: N-[9,10-bis(oxidanylidene)-4-phenylsulfanyl-anthracen-1-yl]-2-methyl-benzamide Openeye Name: N-(9,10-dioxo-4-phenylsulfanyl-1-anthryl)-2-methyl-benzamide CAS Name: N-[9,10-dioxo-4-(phenylthio)-1-anthracenyl]-2-methylbenzamide IUPAC Name: N-(9,10-dioxo-4-phenylsulfanylanthracen-1-yl)-2-methylbenzamide Traditional Name: N-[9,10-diketo-4-(phenylthio)-1-anthryl]-2-methyl-benzamide Formula: C28H19NO3S MolecularWeight: 449.52036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=C3C(=C(C=C2)SC4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=C3C(=C(C=C2)SC4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O

InChI

InChI=1S/C28H19NO3S/c1-17-9-5-6-12-19(17)28(32)29-22-15-16-23(33-18-10-3-2-4-11-18)25-24(22)26(30)20-13-7-8-14-21(20)27(25)31/h2-16H,1H3,(H,29,32)