(3Z)-3-[[[4-[2-[3,4-bis(oxidanyl)phenyl]ethyl]phenyl]amino]-oxidanyl-methylidene]thiochromen-4-one

Systemtic Name: (3Z)-3-[[[4-[2-[3,4-bis(oxidanyl)phenyl]ethyl]phenyl]amino]-oxidanyl-methylidene]thiochromen-4-one Openeye Name: (3Z)-3-[[4-[2-(3,4-dihydroxyphenyl)ethyl]anilino]-hydroxy-methylene]thiochroman-4-one CAS Name: (3Z)-3-[[4-[2-(3,4-dihydroxyphenyl)ethyl]anilino]-hydroxymethylidene]-1-benzothiopyran-4-one IUPAC Name: (3Z)-3-[[4-[2-(3,4-dihydroxyphenyl)ethyl]anilino]-hydroxymethylidene]thiochromen-4-one Traditional Name: (3Z)-3-[[4-[2-(3,4-dihydroxyphenyl)ethyl]anilino]-hydroxy-methylene]thiochroman-4-one Formula: C24H21NO4S MolecularWeight: 419.49284

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(NC2=CC=C(C=C2)CCC3=CC(=C(C=C3)O)O)O)C(=O)C4=CC=CC=C4S1

Isomeric SMILES

C1/C(=C(/NC2=CC=C(C=C2)CCC3=CC(=C(C=C3)O)O)\O)/C(=O)C4=CC=CC=C4S1

InChI

InChI=1S/C24H21NO4S/c26-20-12-9-16(13-21(20)27)6-5-15-7-10-17(11-8-15)25-24(29)19-14-30-22-4-2-1-3-18(22)23(19)28/h1-4,7-13,25-27,29H,5-6,14H2/b24-19+