6-chloranyl-4-oxidanylidene-8-[pyrimidin-2-yl(sulfanyl)methyl]chromene-3-carbaldehyde

Systemtic Name: 6-chloranyl-4-oxidanylidene-8-[pyrimidin-2-yl(sulfanyl)methyl]chromene-3-carbaldehyde Openeye Name: 6-chloro-4-oxo-8-[pyrimidin-2-yl(sulfanyl)methyl]chromene-3-carbaldehyde CAS Name: 6-chloro-8-[mercapto(2-pyrimidinyl)methyl]-4-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 6-chloro-4-oxo-8-[pyrimidin-2-yl(sulfanyl)methyl]chromene-3-carbaldehyde Traditional Name: 6-chloro-4-keto-8-[mercapto(2-pyrimidyl)methyl]chromene-3-carbaldehyde Formula: C15H9ClN2O3S MolecularWeight: 332.76156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)C(C2=C3C(=CC(=C2)Cl)C(=O)C(=CO3)C=O)S

Isomeric SMILES

C1=CN=C(N=C1)C(C2=C3C(=CC(=C2)Cl)C(=O)C(=CO3)C=O)S

InChI

InChI=1S/C15H9ClN2O3S/c16-9-4-10-12(20)8(6-19)7-21-13(10)11(5-9)14(22)15-17-2-1-3-18-15/h1-7,14,22H