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

Systemtic Name: 5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-4-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(4-pyridylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-(diethylamino)-6-ethyl-2-pyrimidinyl]thio]methyl]-N-(pyridin-4-ylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-(diethylamino)-6-ethylpyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-4-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]thio]methyl]-N-(4-pyridylmethyl)-2-furamide Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=NC=C3)N(CC)CC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=NC=C3)N(CC)CC

InChI

InChI=1S/C22H27N5O2S/c1-4-17-13-20(27(5-2)6-3)26-22(25-17)30-15-18-7-8-19(29-18)21(28)24-14-16-9-11-23-12-10-16/h7-13H,4-6,14-15H2,1-3H3,(H,24,28)