N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-[1-(m-tolyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[[1-(3-methylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[[1-(m-tolyl)imidazol-2-yl]thio]acetamide Formula: C26H19N3O3S MolecularWeight: 453.51236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H19N3O3S/c1-16-5-4-6-18(13-16)29-12-11-27-26(29)33-15-23(30)28-17-9-10-21-22(14-17)25(32)20-8-3-2-7-19(20)24(21)31/h2-14H,15H2,1H3,(H,28,30)