2-azanylidene-N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-pyran-3-carboxamide

Systemtic Name: 2-azanylidene-N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-pyran-3-carboxamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-5-(2-hydroxy-5-methoxy-benzoyl)-2-imino-pyran-3-carboxamide CAS Name: N-[4-(difluoromethylthio)phenyl]-5-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-2-imino-3-pyrancarboxamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-5-(2-hydroxy-5-methoxybenzoyl)-2-iminopyran-3-carboxamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-5-(2-hydroxy-5-methoxy-benzoyl)-2-imino-pyran-3-carboxamide Formula: C21H16F2N2O5S MolecularWeight: 446.423946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)C2=COC(=N)C(=C2)C(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)C2=COC(=N)C(=C2)C(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C21H16F2N2O5S/c1-29-13-4-7-17(26)15(9-13)18(27)11-8-16(19(24)30-10-11)20(28)25-12-2-5-14(6-3-12)31-21(22)23/h2-10,21,24,26H,1H3,(H,25,28)