2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N

Isomeric SMILES

C1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N

InChI

InChI=1S/C21H16N2O3S/c22-11-15-9-13-5-1-3-7-17(13)23-20(15)27-12-18(24)16-10-14-6-2-4-8-19(14)26-21(16)25/h2,4,6,8-10H,1,3,5,7,12H2