5-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-furan-2-carboxamide

Systemtic Name: 5-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-furan-2-carboxamide Openeye Name: 5-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-isopropyl-furan-2-carboxamide CAS Name: 5-[[[4-tert-butyl-6-(diethylamino)-2-pyrimidinyl]thio]methyl]-N-propan-2-yl-2-furancarboxamide IUPAC Name: 5-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-ylfuran-2-carboxamide Traditional Name: 5-[[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]thio]methyl]-N-isopropyl-2-furamide Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)C(C)(C)C)SCC2=CC=C(O2)C(=O)NC(C)C

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)C(C)(C)C)SCC2=CC=C(O2)C(=O)NC(C)C

InChI

InChI=1S/C21H32N4O2S/c1-8-25(9-2)18-12-17(21(5,6)7)23-20(24-18)28-13-15-10-11-16(27-15)19(26)22-14(3)4/h10-12,14H,8-9,13H2,1-7H3,(H,22,26)