N-(5-tert-butyl-2-methoxy-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C17H21N3O2S/c1-17(2,3)12-6-7-14(22-4)13(10-12)20-15(21)11-23-16-18-8-5-9-19-16/h5-10H,11H2,1-4H3,(H,20,21)