N-[5-tert-butyl-2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-(4-isopropylsulfanylphenyl)acetamide CAS Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: N-[5-tert-butyl-2-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-[4-(isopropylthio)phenyl]acetamide Formula: C24H31N5O2S MolecularWeight: 453.60024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C(C)(C)C)NC(=O)CC3=CC=C(C=C3)SC(C)C)C

Isomeric SMILES

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C(C)(C)C)NC(=O)CC3=CC=C(C=C3)SC(C)C)C

InChI

InChI=1S/C24H31N5O2S/c1-14(2)32-18-10-8-17(9-11-18)12-21(30)26-20-13-19(24(5,6)7)28-29(20)23-25-16(4)15(3)22(31)27-23/h8-11,13-14H,12H2,1-7H3,(H,26,30)(H,25,27,31)