2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-thiazol-2-yl-acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N-(2-thiazolyl)acetamide IUPAC Name: 2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-thiazol-2-yl-acetamide Formula: C20H15FN4O3S2 MolecularWeight: 442.486503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)N(CC(=O)NC3=NC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)N(CC(=O)NC3=NC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H15FN4O3S2/c21-15-4-6-16(7-5-15)25(13-19(26)24-20-23-10-11-29-20)30(27,28)18-3-1-2-14-12-22-9-8-17(14)18/h1-12H,13H2,(H,23,24,26)