2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-(5-tert-butyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-tert-butyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C20H24N6OS MolecularWeight: 396.50916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C)N

InChI

InChI=1S/C20H24N6OS/c1-13-10-16(21)23-19(22-13)28-12-18(27)24-17-11-15(20(2,3)4)25-26(17)14-8-6-5-7-9-14/h5-11H,12H2,1-4H3,(H,24,27)(H2,21,22,23)