(2Z)-6-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-(phenylmethylidene)-4H-1,4-benzothiazin-3-one

Systemtic Name: (2Z)-6-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-(phenylmethylidene)-4H-1,4-benzothiazin-3-one Openeye Name: (2Z)-2-benzylidene-6-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4H-1,4-benzothiazin-3-one CAS Name: (2Z)-6-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-(phenylmethylene)-4H-1,4-benzothiazin-3-one IUPAC Name: (2Z)-2-benzylidene-6-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4H-1,4-benzothiazin-3-one Traditional Name: (2Z)-2-benzal-6-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4H-1,4-benzothiazin-3-one Formula: C25H20N2O2S MolecularWeight: 412.5035

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)SC(=CC5=CC=CC=C5)C(=O)N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)S/C(=C\C5=CC=CC=C5)/C(=O)N4

InChI

InChI=1S/C25H20N2O2S/c28-24-23(14-17-6-2-1-3-7-17)30-22-11-10-19(15-21(22)26-24)25(29)27-13-12-18-8-4-5-9-20(18)16-27/h1-11,14-15H,12-13,16H2,(H,26,28)/b23-14-