N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-2-[[4-(2-thienyl)pyrimidin-2-yl]thio]acetamide Formula: C20H15ClFN5OS2 MolecularWeight: 459.947403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=CC(=N2)NC(=O)CSC3=NC=CC(=N3)C4=CC=CS4)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=CC(=N2)NC(=O)CSC3=NC=CC(=N3)C4=CC=CS4)F

InChI

InChI=1S/C20H15ClFN5OS2/c21-14-3-1-4-15(22)13(14)11-27-9-7-18(26-27)25-19(28)12-30-20-23-8-6-16(24-20)17-5-2-10-29-17/h1-10H,11-12H2,(H,25,26,28)