1-[4-(5-chloranylpyridin-2-yl)oxypiperidin-1-yl]sulfonyl-1-pyrimidin-2-yl-butan-2-one

Systemtic Name: 1-[4-(5-chloranylpyridin-2-yl)oxypiperidin-1-yl]sulfonyl-1-pyrimidin-2-yl-butan-2-one Openeye Name: 1-[[4-[(5-chloro-2-pyridyl)oxy]-1-piperidyl]sulfonyl]-1-pyrimidin-2-yl-butan-2-one CAS Name: 1-[[4-[(5-chloro-2-pyridinyl)oxy]-1-piperidinyl]sulfonyl]-1-(2-pyrimidinyl)-2-butanone IUPAC Name: 1-[4-(5-chloropyridin-2-yl)oxypiperidin-1-yl]sulfonyl-1-pyrimidin-2-ylbutan-2-one Traditional Name: 1-[4-[(5-chloro-2-pyridyl)oxy]piperidino]sulfonyl-1-(2-pyrimidyl)butan-2-one Formula: C18H21ClN4O4S MolecularWeight: 424.90174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=NC=CC=N1)S(=O)(=O)N2CCC(CC2)OC3=NC=C(C=C3)Cl

Isomeric SMILES

CCC(=O)C(C1=NC=CC=N1)S(=O)(=O)N2CCC(CC2)OC3=NC=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN4O4S/c1-2-15(24)17(18-20-8-3-9-21-18)28(25,26)23-10-6-14(7-11-23)27-16-5-4-13(19)12-22-16/h3-5,8-9,12,14,17H,2,6-7,10-11H2,1H3