N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(9,10-dioxo-1-anthracenyl)acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C29H21N3O3S2 MolecularWeight: 523.62534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCC(=O)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCC(=O)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C29H21N3O3S2/c33-25(17-37-20-15-13-19(14-16-20)31-29(36)30-18-7-2-1-3-8-18)32-24-12-6-11-23-26(24)28(35)22-10-5-4-9-21(22)27(23)34/h1-16H,17H2,(H,32,33)(H2,30,31,36)