1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrimidylthio)ethanone Formula: C15H15N3OS MolecularWeight: 285.3641

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C15H15N3OS/c19-14(11-20-15-16-7-3-8-17-15)18-9-6-12-4-1-2-5-13(12)10-18/h1-5,7-8H,6,9-11H2