5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-morpholin-4-yl-furan-2-carboxamide

Systemtic Name: 5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-morpholin-4-yl-furan-2-carboxamide Openeye Name: 5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-morpholino-furan-2-carboxamide CAS Name: 5-[[[4-tert-butyl-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]methyl]-N-(4-morpholinyl)-2-furancarboxamide IUPAC Name: 5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-morpholin-4-ylfuran-2-carboxamide Traditional Name: 5-[[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]methyl]-N-morpholino-2-furamide Formula: C25H37N5O3S MolecularWeight: 487.65798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NN3CCOCC3)N(C)C4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NN3CCOCC3)N(C)C4CCCCC4

InChI

InChI=1S/C25H37N5O3S/c1-25(2,3)21-16-22(29(4)18-8-6-5-7-9-18)27-24(26-21)34-17-19-10-11-20(33-19)23(31)28-30-12-14-32-15-13-30/h10-11,16,18H,5-9,12-15,17H2,1-4H3,(H,28,31)