N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C24H16N4O3S MolecularWeight: 440.47384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H16N4O3S/c29-21(13-32-24-27-25-14-28(24)16-6-2-1-3-7-16)26-15-10-11-19-20(12-15)23(31)18-9-5-4-8-17(18)22(19)30/h1-12,14H,13H2,(H,26,29)