7-(2-oxidanylidenepropylsulfanyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbonitrile

Systemtic Name: 7-(2-oxidanylidenepropylsulfanyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbonitrile Openeye Name: 7-acetonylsulfanyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbonitrile CAS Name: 7-(2-oxopropylthio)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbonitrile IUPAC Name: 7-(2-oxopropylsulfanyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbonitrile Traditional Name: 7-(acetonylthio)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbonitrile Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=CC3=C(C=C2C=C1C#N)OCCO3

Isomeric SMILES

CC(=O)CSC1=NC2=CC3=C(C=C2C=C1C#N)OCCO3

InChI

InChI=1S/C15H12N2O3S/c1-9(18)8-21-15-11(7-16)4-10-5-13-14(6-12(10)17-15)20-3-2-19-13/h4-6H,2-3,8H2,1H3