2-azanyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-ketocyclohexa-2,5-dien-1-ylidene)-6-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1H-pyridine-3,5-dicarbonitrile Formula: C22H16N4O3S MolecularWeight: 416.45244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=C3C=CC(=O)C=C3)C(=C(N2)N)C#N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=C3C=CC(=O)C=C3)C(=C(N2)N)C#N)C#N

InChI

InChI=1S/C22H16N4O3S/c1-29-16-8-4-13(5-9-16)19(28)12-30-22-18(11-24)20(17(10-23)21(25)26-22)14-2-6-15(27)7-3-14/h2-9,26H,12,25H2,1H3