5-[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(oxolan-2-ylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(oxolan-2-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(tetrahydrofuran-2-ylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-(diethylamino)-6-phenyl-2-pyrimidinyl]thio]methyl]-N-(2-oxolanylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-(diethylamino)-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-(oxolan-2-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-(tetrahydrofurfuryl)-2-furamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=C(O3)C(=O)NCC4CCCO4

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=C(O3)C(=O)NCC4CCCO4

InChI

InChI=1S/C25H30N4O3S/c1-3-29(4-2)23-15-21(18-9-6-5-7-10-18)27-25(28-23)33-17-20-12-13-22(32-20)24(30)26-16-19-11-8-14-31-19/h5-7,9-10,12-13,15,19H,3-4,8,11,14,16-17H2,1-2H3,(H,26,30)