N-[4-[2-[3,4-bis(oxidanyl)phenyl]ethyl]phenyl]-1,1,4-tris(oxidanylidene)-2,3-dihydrothiochromene-3-carboxamide

Systemtic Name: N-[4-[2-[3,4-bis(oxidanyl)phenyl]ethyl]phenyl]-1,1,4-tris(oxidanylidene)-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[4-[2-(3,4-dihydroxyphenyl)ethyl]phenyl]-1,1,4-trioxo-2,3-dihydrothiochromene-3-carboxamide CAS Name: N-[4-[2-(3,4-dihydroxyphenyl)ethyl]phenyl]-1,1,4-trioxo-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[4-[2-(3,4-dihydroxyphenyl)ethyl]phenyl]-1,1,4-trioxo-2,3-dihydrothiochromene-3-carboxamide Traditional Name: N-[4-[2-(3,4-dihydroxyphenyl)ethyl]phenyl]-1,1,4-triketo-2,3-dihydrothiochromene-3-carboxamide Formula: C24H21NO6S MolecularWeight: 451.49164

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CC=C2S1(=O)=O)C(=O)NC3=CC=C(C=C3)CCC4=CC(=C(C=C4)O)O

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C2S1(=O)=O)C(=O)NC3=CC=C(C=C3)CCC4=CC(=C(C=C4)O)O

InChI

InChI=1S/C24H21NO6S/c26-20-12-9-16(13-21(20)27)6-5-15-7-10-17(11-8-15)25-24(29)19-14-32(30,31)22-4-2-1-3-18(22)23(19)28/h1-4,7-13,19,26-27H,5-6,14H2,(H,25,29)