N-[[3,4-bis(oxidanyl)phenyl]methyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide

Systemtic Name: N-[[3,4-bis(oxidanyl)phenyl]methyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[(3,4-dihydroxyphenyl)methyl]-4-oxo-N-phenyl-thiochromane-3-carboxamide CAS Name: N-[(3,4-dihydroxyphenyl)methyl]-4-oxo-N-phenyl-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[(3,4-dihydroxyphenyl)methyl]-4-oxo-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Traditional Name: 4-keto-N-phenyl-N-protocatechuyl-thiochroman-3-carboxamide Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CC=C2S1)C(=O)N(CC3=CC(=C(C=C3)O)O)C4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C2S1)C(=O)N(CC3=CC(=C(C=C3)O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H19NO4S/c25-19-11-10-15(12-20(19)26)13-24(16-6-2-1-3-7-16)23(28)18-14-29-21-9-5-4-8-17(21)22(18)27/h1-12,18,25-26H,13-14H2