N-(3-chloranyl-4-methyl-phenyl)-2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]acetamide Formula: C24H19ClFN3O3S MolecularWeight: 483.942363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4)Cl

InChI

InChI=1S/C24H19ClFN3O3S/c1-16-5-8-19(13-22(16)25)28-24(30)15-29(20-9-6-18(26)7-10-20)33(31,32)23-4-2-3-17-14-27-12-11-21(17)23/h2-14H,15H2,1H3,(H,28,30)