9-butan-2-yl-3-methyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carbonitrile

Systemtic Name: 9-butan-2-yl-3-methyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carbonitrile Openeye Name: 3-methyl-4-oxo-9-sec-butyl-5H-thiochromeno[4,3-b]pyran-2-carbonitrile CAS Name: 9-butan-2-yl-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carbonitrile IUPAC Name: 9-butan-2-yl-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carbonitrile Traditional Name: 4-keto-3-methyl-9-sec-butyl-5H-thiochromeno[4,3-b]pyran-2-carbonitrile Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)SCC3=C2OC(=C(C3=O)C)C#N

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)SCC3=C2OC(=C(C3=O)C)C#N

InChI

InChI=1S/C18H17NO2S/c1-4-10(2)12-5-6-16-13(7-12)18-14(9-22-16)17(20)11(3)15(8-19)21-18/h5-7,10H,4,9H2,1-3H3