3-[(9-methoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]benzenesulfonamide

Systemtic Name: 3-[(9-methoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]benzenesulfonamide Openeye Name: 3-[(9-methoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]benzenesulfonamide CAS Name: 3-[(9-methoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]benzenesulfonamide IUPAC Name: 3-[(9-methoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]benzenesulfonamide Traditional Name: 3-[(4-keto-9-methoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-2-yl)amino]benzenesulfonamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=CC(=NC(=O)N3CC2)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

COC1=CC2=C(C=C1)C3=CC(=NC(=O)N3CC2)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C19H18N4O4S/c1-27-14-5-6-16-12(9-14)7-8-23-17(16)11-18(22-19(23)24)21-13-3-2-4-15(10-13)28(20,25)26/h2-6,9-11H,7-8H2,1H3,(H2,20,25,26)(H,21,22,24)