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

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(9,10-dioxo-1-anthracenyl)propanamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylpropanamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]propionamide Formula: C30H23N3O3S2 MolecularWeight: 537.65192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

InChI

InChI=1S/C30H23N3O3S2/c1-18(38-21-16-14-20(15-17-21)32-30(37)31-19-8-3-2-4-9-19)29(36)33-25-13-7-12-24-26(25)28(35)23-11-6-5-10-22(23)27(24)34/h2-18H,1H3,(H,33,36)(H2,31,32,37)