2-(isoquinolin-5-yloxymethyl)-N-(2-methylsulfanylethyl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(isoquinolin-5-yloxymethyl)-N-(2-methylsulfanylethyl)-1,3-oxazole-4-carboxamide Openeye Name: 2-(5-isoquinolyloxymethyl)-N-(2-methylsulfanylethyl)oxazole-4-carboxamide CAS Name: 2-(5-isoquinolinyloxymethyl)-N-[2-(methylthio)ethyl]-4-oxazolecarboxamide IUPAC Name: 2-(isoquinolin-5-yloxymethyl)-N-(2-methylsulfanylethyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-(5-isoquinolyloxymethyl)-N-[2-(methylthio)ethyl]oxazole-4-carboxamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNC(=O)C1=COC(=N1)COC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CSCCNC(=O)C1=COC(=N1)COC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H17N3O3S/c1-24-8-7-19-17(21)14-10-23-16(20-14)11-22-15-4-2-3-12-9-18-6-5-13(12)15/h2-6,9-10H,7-8,11H2,1H3,(H,19,21)