5-[(4-tert-butyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-cyclopropyl-furan-2-carboxamide

Systemtic Name: 5-[(4-tert-butyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-cyclopropyl-furan-2-carboxamide Openeye Name: 5-[(4-tert-butyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-cyclopropyl-furan-2-carboxamide CAS Name: 5-[[[4-tert-butyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]-N-cyclopropyl-2-furancarboxamide IUPAC Name: 5-[(4-tert-butyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]-N-cyclopropylfuran-2-carboxamide Traditional Name: 5-[[(4-tert-butyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]-N-cyclopropyl-2-furamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NC3CC3)N4CCCC4

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NC3CC3)N4CCCC4

InChI

InChI=1S/C21H28N4O2S/c1-21(2,3)17-12-18(25-10-4-5-11-25)24-20(23-17)28-13-15-8-9-16(27-15)19(26)22-14-6-7-14/h8-9,12,14H,4-7,10-11,13H2,1-3H3,(H,22,26)