N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]acetamide Formula: C24H22ClN3O2S MolecularWeight: 451.96838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C)Cl

InChI

InChI=1S/C24H22ClN3O2S/c1-15-7-8-17(12-21(15)25)11-19-14-26-24(31-19)27-23(30)13-22-20-6-4-3-5-18(20)9-10-28(22)16(2)29/h3-10,12,14,22H,11,13H2,1-2H3,(H,26,27,30)