N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]phenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[4-[(3R,5R)-3,5-dimethylpiperidino]sulfonylphenyl]-2-(2-pyrimidylthio)acetamide Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CC=N3)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CC=N3)C

InChI

InChI=1S/C19H24N4O3S2/c1-14-10-15(2)12-23(11-14)28(25,26)17-6-4-16(5-7-17)22-18(24)13-27-19-20-8-3-9-21-19/h3-9,14-15H,10-13H2,1-2H3,(H,22,24)/t14-,15-/m1/s1