1-(4-morpholin-4-ylsulfonylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-morpholin-4-ylsulfonylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-morpholinosulfonylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-[4-(4-morpholinylsulfonyl)phenyl]-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(4-morpholin-4-ylsulfonylphenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(4-morpholinosulfonylphenyl)-2-(2-pyrimidylthio)ethanone Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C16H17N3O4S2/c20-15(12-24-16-17-6-1-7-18-16)13-2-4-14(5-3-13)25(21,22)19-8-10-23-11-9-19/h1-7H,8-12H2