N-(4-piperidin-1-ylsulfonylphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-piperidin-1-ylsulfonylphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[4-(1-piperidylsulfonyl)phenyl]-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[4-(1-piperidinylsulfonyl)phenyl]-2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(4-piperidin-1-ylsulfonylphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(4-piperidinosulfonylphenyl)-2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C22H21F3N4O3S3 MolecularWeight: 542.61735

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C22H21F3N4O3S3/c23-22(24,25)19-13-17(18-5-4-12-33-18)27-21(28-19)34-14-20(30)26-15-6-8-16(9-7-15)35(31,32)29-10-2-1-3-11-29/h4-9,12-13H,1-3,10-11,14H2,(H,26,30)