2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C23H30N4O2S/c1-3-4-5-6-7-8-13-22-25-26-23(30-22)24-21(29)16-20-19-12-10-9-11-18(19)14-15-27(20)17(2)28/h9-12,14-15,20H,3-8,13,16H2,1-2H3,(H,24,26,29)