3-methylsulfanyl-1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-methylsulfanyl-1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-methylsulfanyl-1-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(methylthio)-1-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-methylsulfanyl-1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(methylthio)-1-[4-(5-morpholinosulfonyl-2-pyridyl)piperazino]propan-1-one Formula: C17H26N4O4S2 MolecularWeight: 414.54274

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCN(CC1)C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CSCCC(=O)N1CCN(CC1)C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H26N4O4S2/c1-26-13-4-17(22)20-7-5-19(6-8-20)16-3-2-15(14-18-16)27(23,24)21-9-11-25-12-10-21/h2-3,14H,4-13H2,1H3