N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NCCSCC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NCCSCC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C23H21NO4S/c25-22(24-10-12-29-15-19-7-4-11-27-19)17-8-9-20-18(13-17)14-21(28-23(20)26)16-5-2-1-3-6-16/h1-9,11,13,21H,10,12,14-15H2,(H,24,25)