N-[(S)-[(1R)-6-methoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]-phenyl-methyl]-4-methyl-benzenesulfinamide

Systemtic Name: N-[(S)-[(1R)-6-methoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]-phenyl-methyl]-4-methyl-benzenesulfinamide Openeye Name: N-[(S)-[(1R)-6-methoxy-3-oxo-1H-isobenzofuran-1-yl]-phenyl-methyl]-4-methyl-benzenesulfinamide CAS Name: N-[(S)-[(1R)-6-methoxy-3-oxo-1H-isobenzofuran-1-yl]-phenylmethyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(S)-[(1R)-6-methoxy-3-oxo-1H-2-benzofuran-1-yl]-phenylmethyl]-4-methylbenzenesulfinamide Traditional Name: N-[(S)-[(1R)-3-keto-6-methoxy-phthalan-1-yl]-phenyl-methyl]-4-methyl-benzenesulfinamide Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(C2C3=C(C=CC(=C3)OC)C(=O)O2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)N[C@H]([C@H]2C3=C(C=CC(=C3)OC)C(=O)O2)C4=CC=CC=C4

InChI

InChI=1S/C23H21NO4S/c1-15-8-11-18(12-9-15)29(26)24-21(16-6-4-3-5-7-16)22-20-14-17(27-2)10-13-19(20)23(25)28-22/h3-14,21-22,24H,1-2H3/t21-,22+,29-/m0/s1