1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)-2-(2-pyrimidylthio)ethanone Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C16H17N3O3S2/c1-24(21,22)19-9-2-4-12-10-13(5-6-14(12)19)15(20)11-23-16-17-7-3-8-18-16/h3,5-8,10H,2,4,9,11H2,1H3