7-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-1-(1,3-thiazol-2-yl)-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-1-(1,3-thiazol-2-yl)-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-1-thiazol-2-yl-1,8-naphthyridine-3-carboxylic acid CAS Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-1-(1,3-thiazol-2-yl)-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-1-thiazol-2-yl-1,8-naphthyridine-3-carboxylic acid Formula: C21H16N4O3S MolecularWeight: 404.44174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC4=C(C=C3)C(=O)C(=CN4C5=NC=CS5)C(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC4=C(C=C3)C(=O)C(=CN4C5=NC=CS5)C(=O)O

InChI

InChI=1S/C21H16N4O3S/c26-18-15-5-6-17(24-9-7-13-3-1-2-4-14(13)11-24)23-19(15)25(12-16(18)20(27)28)21-22-8-10-29-21/h1-6,8,10,12H,7,9,11H2,(H,27,28)