N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propionamide Formula: C24H20N6OS MolecularWeight: 440.5202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SC(C)C(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)SC(C)C(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C24H20N6OS/c1-16(32-22-13-21(27-17(2)28-22)18-9-5-3-6-10-18)24(31)29-23-19(14-25)15-26-30(23)20-11-7-4-8-12-20/h3-13,15-16H,1-2H3,(H,29,31)