4-tert-butyl-N-(2-methylsulfanylpyrimidin-4-yl)benzamide

Systemtic Name: 4-tert-butyl-N-(2-methylsulfanylpyrimidin-4-yl)benzamide Openeye Name: 4-tert-butyl-N-(2-methylsulfanylpyrimidin-4-yl)benzamide CAS Name: 4-tert-butyl-N-[2-(methylthio)-4-pyrimidinyl]benzamide IUPAC Name: 4-tert-butyl-N-(2-methylsulfanylpyrimidin-4-yl)benzamide Traditional Name: 4-tert-butyl-N-[2-(methylthio)pyrimidin-4-yl]benzamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=NC=C2)SC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=NC=C2)SC

InChI

InChI=1S/C16H19N3OS/c1-16(2,3)12-7-5-11(6-8-12)14(20)18-13-9-10-17-15(19-13)21-4/h5-10H,1-4H3,(H,17,18,19,20)