5-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-methyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]-N-(2-pyridinylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]-N-(2-pyridylmethyl)-2-furamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)C)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)C)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C21H25N5O2S/c1-4-11-26(3)19-12-15(2)24-21(25-19)29-14-17-8-9-18(28-17)20(27)23-13-16-7-5-6-10-22-16/h5-10,12H,4,11,13-14H2,1-3H3,(H,23,27)