N-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Openeye Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]pyridine-3-carboxamide CAS Name: N-[5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Traditional Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-keto-5,6-dihydro-4H-1,3-benzothiazol-2-yl]nicotinamide Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3CC4=C(C(=O)C3)SC(=N4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3CC4=C(C(=O)C3)SC(=N4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C23H20N4O3S/c28-19-11-17(22(30)27-9-7-14-4-1-2-5-16(14)13-27)10-18-20(19)31-23(25-18)26-21(29)15-6-3-8-24-12-15/h1-6,8,12,17H,7,9-11,13H2,(H,25,26,29)