N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(6-oxidanyl-4-oxidanylidene-1-propyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(6-oxidanyl-4-oxidanylidene-1-propyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(6-hydroxy-4-oxo-1-propyl-pyrimidin-2-yl)sulfanyl-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(6-hydroxy-4-oxo-1-propyl-2-pyrimidinyl)thio]-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-hydroxy-4-oxo-1-propylpyrimidin-2-yl)sulfanyl-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(6-hydroxy-4-keto-1-propyl-pyrimidin-2-yl)thio]-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C21H28N4O5S2 MolecularWeight: 480.60082

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=O)N=C1SCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3)O

Isomeric SMILES

CCCN1C(=CC(=O)N=C1SCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3)O

InChI

InChI=1S/C21H28N4O5S2/c1-3-9-25-20(28)13-18(26)23-21(25)31-14-19(27)22-16-8-7-15(2)17(12-16)32(29,30)24-10-5-4-6-11-24/h7-8,12-13,28H,3-6,9-11,14H2,1-2H3,(H,22,27)