5-[[4-ethyl-6-[methyl-(phenylmethyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-ethyl-6-[methyl-(phenylmethyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide Openeye Name: 5-[[4-[benzyl(methyl)amino]-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-[2-(2-pyridyl)ethyl]furan-2-carboxamide CAS Name: 5-[[[4-ethyl-6-[methyl-(phenylmethyl)amino]-2-pyrimidinyl]thio]methyl]-N-[2-(2-pyridinyl)ethyl]-2-furancarboxamide IUPAC Name: 5-[[4-[benzyl(methyl)amino]-6-ethylpyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide Traditional Name: 5-[[[4-[benzyl(methyl)amino]-6-ethyl-pyrimidin-2-yl]thio]methyl]-N-[2-(2-pyridyl)ethyl]-2-furamide Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCCC3=CC=CC=N3)N(C)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCCC3=CC=CC=N3)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N5O2S/c1-3-21-17-25(32(2)18-20-9-5-4-6-10-20)31-27(30-21)35-19-23-12-13-24(34-23)26(33)29-16-14-22-11-7-8-15-28-22/h4-13,15,17H,3,14,16,18-19H2,1-2H3,(H,29,33)