2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide IUPAC Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C[C@H]3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C21H19N3O2S/c1-13-22-18-8-7-16(11-20(18)27-13)23-21(26)12-19-17-6-4-3-5-15(17)9-10-24(19)14(2)25/h3-11,19H,12H2,1-2H3,(H,23,26)/t19-/m0/s1