2-isoquinolin-1-ylsulfanyl-N-(oxan-3-yl)ethanamide

Systemtic Name: 2-isoquinolin-1-ylsulfanyl-N-(oxan-3-yl)ethanamide Openeye Name: 2-(1-isoquinolylsulfanyl)-N-tetrahydropyran-3-yl-acetamide CAS Name: 2-(1-isoquinolinylthio)-N-(3-oxanyl)acetamide IUPAC Name: 2-isoquinolin-1-ylsulfanyl-N-(oxan-3-yl)acetamide Traditional Name: 2-(1-isoquinolylthio)-N-tetrahydropyran-3-yl-acetamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(COC1)NC(=O)CSC2=NC=CC3=CC=CC=C32

Isomeric SMILES

C1CC(COC1)NC(=O)CSC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C16H18N2O2S/c19-15(18-13-5-3-9-20-10-13)11-21-16-14-6-2-1-4-12(14)7-8-17-16/h1-2,4,6-8,13H,3,5,9-11H2,(H,18,19)