4,6-dimethyl-2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-5-(phenylmethyl)pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-5-(phenylmethyl)pyridine-3-carbonitrile Openeye Name: 5-benzyl-4,6-dimethyl-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-5-(phenylmethyl)-3-pyridinecarbonitrile IUPAC Name: 5-benzyl-4,6-dimethyl-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 5-benzyl-2-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C26H20N2O3S MolecularWeight: 440.5136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1CC2=CC=CC=C2)C)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1CC2=CC=CC=C2)C)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N

InChI

InChI=1S/C26H20N2O3S/c1-16-20(12-18-8-4-3-5-9-18)17(2)28-25(22(16)14-27)32-15-23(29)21-13-19-10-6-7-11-24(19)31-26(21)30/h3-11,13H,12,15H2,1-2H3