N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetamide Formula: C24H21FN4O3S MolecularWeight: 464.511943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C[C@H]3C4=CC=CC=C4C=CN3C(=O)C)F

InChI

InChI=1S/C24H21FN4O3S/c1-14(30)26-17-7-8-19(20(25)11-17)21-13-33-24(27-21)28-23(32)12-22-18-6-4-3-5-16(18)9-10-29(22)15(2)31/h3-11,13,22H,12H2,1-2H3,(H,26,30)(H,27,28,32)/t22-/m0/s1