(3R)-6-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)-3-phenyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3R)-6-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)-3-phenyl-3,4-dihydroisochromen-1-one Openeye Name: (3R)-6-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-3-phenyl-isochroman-1-one CAS Name: (3R)-6-[3,4-dihydro-2H-1,5-benzothiazepin-5-yl(oxo)methyl]-3-phenyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3R)-6-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-3-phenyl-3,4-dihydroisochromen-1-one Traditional Name: (3R)-6-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-3-phenyl-isochroman-1-one Formula: C25H21NO3S MolecularWeight: 415.50414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3=CC4=C(C=C3)C(=O)O[C@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C25H21NO3S/c27-24(26-13-6-14-30-23-10-5-4-9-21(23)26)18-11-12-20-19(15-18)16-22(29-25(20)28)17-7-2-1-3-8-17/h1-5,7-12,15,22H,6,13-14,16H2/t22-/m1/s1