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

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[(1-methyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[(1-methylbenzimidazol-2-yl)thio]propionamide Formula: C25H19N3O3S MolecularWeight: 441.50166

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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=C5N4C

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)SC4=NC5=CC=CC=C5N4C

InChI

InChI=1S/C25H19N3O3S/c1-14(32-25-27-20-9-5-6-10-21(20)28(25)2)24(31)26-15-11-12-18-19(13-15)23(30)17-8-4-3-7-16(17)22(18)29/h3-14H,1-2H3,(H,26,31)