N-(5-tert-butyl-2-oxidanyl-phenyl)-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-5-chloro-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C16H18ClN3O2S/c1-16(2,3)9-5-6-12(21)11(7-9)19-14(22)13-10(17)8-18-15(20-13)23-4/h5-8,21H,1-4H3,(H,19,22)