N-[5-(diethylsulfamoyl)-2-piperidin-1-yl-phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-piperidin-1-yl-phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(1-piperidyl)phenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-piperidinyl)phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-piperidin-1-ylphenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[5-(diethylsulfamoyl)-2-piperidino-phenyl]-2-(2-pyrimidylthio)acetamide Formula: C21H29N5O3S2 MolecularWeight: 463.61666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C21H29N5O3S2/c1-3-26(4-2)31(28,29)17-9-10-19(25-13-6-5-7-14-25)18(15-17)24-20(27)16-30-21-22-11-8-12-23-21/h8-12,15H,3-7,13-14,16H2,1-2H3,(H,24,27)