2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C[C@@H]3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C21H19N3O2S/c1-13-6-5-9-18-20(13)23-21(27-18)22-19(26)12-17-16-8-4-3-7-15(16)10-11-24(17)14(2)25/h3-11,17H,12H2,1-2H3,(H,22,23,26)/t17-/m1/s1