[5-[(4-morpholin-4-yl-6-propan-2-yl-pyrimidin-2-yl)sulfanylmethyl]furan-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-[(4-morpholin-4-yl-6-propan-2-yl-pyrimidin-2-yl)sulfanylmethyl]furan-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-[(4-isopropyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]-2-furyl]-pyrrolidin-1-yl-methanone CAS Name: [5-[[[4-(4-morpholinyl)-6-propan-2-yl-2-pyrimidinyl]thio]methyl]-2-furanyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-[(4-morpholin-4-yl-6-propan-2-ylpyrimidin-2-yl)sulfanylmethyl]furan-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-[[(4-isopropyl-6-morpholino-pyrimidin-2-yl)thio]methyl]-2-furyl]-pyrrolidino-methanone Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)N3CCCC3)N4CCOCC4

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)N3CCCC3)N4CCOCC4

InChI

InChI=1S/C21H28N4O3S/c1-15(2)17-13-19(24-9-11-27-12-10-24)23-21(22-17)29-14-16-5-6-18(28-16)20(26)25-7-3-4-8-25/h5-6,13,15H,3-4,7-12,14H2,1-2H3