ethyl 6-[2-[[9,10-bis(oxidanylidene)anthracen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[2-[[9,10-bis(oxidanylidene)anthracen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-[(9,10-dioxo-2-anthryl)amino]-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[(9,10-dioxo-2-anthracenyl)amino]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-[(9,10-dioxoanthracen-2-yl)amino]-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-[(9,10-diketo-2-anthryl)amino]-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C26H19N3O5S MolecularWeight: 485.51116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C26H19N3O5S/c1-3-34-26(33)20-10-15(12-27)25(28-14(20)2)35-13-22(30)29-16-8-9-19-21(11-16)24(32)18-7-5-4-6-17(18)23(19)31/h4-11H,3,13H2,1-2H3,(H,29,30)