8-butoxy-3-methyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carbonitrile

Systemtic Name: 8-butoxy-3-methyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carbonitrile Openeye Name: 8-butoxy-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carbonitrile CAS Name: 8-butoxy-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carbonitrile IUPAC Name: 8-butoxy-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carbonitrile Traditional Name: 8-butoxy-4-keto-3-methyl-5H-thiochromeno[4,3-b]pyran-2-carbonitrile Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C3=C(CS2)C(=O)C(=C(O3)C#N)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C3=C(CS2)C(=O)C(=C(O3)C#N)C

InChI

InChI=1S/C18H17NO3S/c1-3-4-7-21-12-5-6-13-16(8-12)23-10-14-17(20)11(2)15(9-19)22-18(13)14/h5-6,8H,3-4,7,10H2,1-2H3