N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)acetamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=NC4=CC5=C(C=C4S3)OCCO5

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=NC4=CC5=C(C=C4S3)OCCO5

InChI

InChI=1S/C22H19N3O4S/c1-13(26)25-7-6-14-4-2-3-5-15(14)17(25)11-21(27)24-22-23-16-10-18-19(12-20(16)30-22)29-9-8-28-18/h2-7,10,12,17H,8-9,11H2,1H3,(H,23,24,27)