2-isoquinolin-1-ylsulfanyl-N-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-isoquinolin-1-ylsulfanyl-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-(1-isoquinolylsulfanyl)-N-(4-morpholinophenyl)acetamide CAS Name: 2-(1-isoquinolinylthio)-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-isoquinolin-1-ylsulfanyl-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-(1-isoquinolylthio)-N-(4-morpholinophenyl)acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)CSC3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)CSC3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O2S/c25-20(15-27-21-19-4-2-1-3-16(19)9-10-22-21)23-17-5-7-18(8-6-17)24-11-13-26-14-12-24/h1-10H,11-15H2,(H,23,25)