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

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[(1-phenethyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[(1-phenethylbenzimidazol-2-yl)thio]propionamide Formula: C32H25N3O3S MolecularWeight: 531.6242

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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=NC5=CC=CC=C5N4CCC6=CC=CC=C6

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)SC4=NC5=CC=CC=C5N4CCC6=CC=CC=C6

InChI

InChI=1S/C32H25N3O3S/c1-20(39-32-34-27-13-7-8-14-28(27)35(32)18-17-21-9-3-2-4-10-21)31(38)33-22-15-16-25-26(19-22)30(37)24-12-6-5-11-23(24)29(25)36/h2-16,19-20H,17-18H2,1H3,(H,33,38)