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

Systemtic Name: 5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(cyclopropylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(cyclopropylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-tert-butyl-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]methyl]-N-(cyclopropylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(cyclopropylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]methyl]-N-(cyclopropylmethyl)-2-furamide Formula: C25H36N4O2S MolecularWeight: 456.64394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3CC3)N(C)C4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3CC3)N(C)C4CCCCC4

InChI

InChI=1S/C25H36N4O2S/c1-25(2,3)21-14-22(29(4)18-8-6-5-7-9-18)28-24(27-21)32-16-19-12-13-20(31-19)23(30)26-15-17-10-11-17/h12-14,17-18H,5-11,15-16H2,1-4H3,(H,26,30)