N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-2-[(6-phenyl-4-pyrimidinyl)thio]acetamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-2-(6-phenylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(6-phenylpyrimidin-4-yl)thio]acetamide Formula: C17H14N6OS MolecularWeight: 350.39766

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C#N)NC(=O)CSC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C=N1)C#N)NC(=O)CSC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H14N6OS/c1-23-17(13(8-18)9-21-23)22-15(24)10-25-16-7-14(19-11-20-16)12-5-3-2-4-6-12/h2-7,9,11H,10H2,1H3,(H,22,24)