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

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-2-[(4-propoxy-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-propoxypyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-2-[(4-propoxypyrimidin-2-yl)thio]acetamide Formula: C19H19ClFN5O2S MolecularWeight: 435.902863

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC=C1)SCC(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCCOC1=NC(=NC=C1)SCC(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H19ClFN5O2S/c1-2-10-28-18-6-8-22-19(24-18)29-12-17(27)23-16-7-9-26(25-16)11-13-14(20)4-3-5-15(13)21/h3-9H,2,10-12H2,1H3,(H,23,25,27)