2-[3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]sulfanylethanamide

Systemtic Name: 2-[3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]sulfanylethanamide Openeye Name: 2-[3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]sulfanylacetamide CAS Name: 2-[[3-(4-chlorophenyl)-2,5-dimethyl-7-pyrazolo[1,5-a]pyrimidinyl]thio]acetamide IUPAC Name: 2-[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanylacetamide Traditional Name: 2-[[3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]thio]acetamide Formula: C16H15ClN4OS MolecularWeight: 346.8345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)SCC(=O)N)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)SCC(=O)N)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN4OS/c1-9-7-14(23-8-13(18)22)21-16(19-9)15(10(2)20-21)11-3-5-12(17)6-4-11/h3-7H,8H2,1-2H3,(H2,18,22)