N-[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[2-(5-methyl-2-furyl)-2-morpholino-ethyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[2-(5-methyl-2-furyl)-2-morpholino-ethyl]-3-(2-pyrimidylamino)benzamide Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3)N4CCOCC4

Isomeric SMILES

CC1=CC=C(O1)C(CNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3)N4CCOCC4

InChI

InChI=1S/C22H25N5O3/c1-16-6-7-20(30-16)19(27-10-12-29-13-11-27)15-25-21(28)17-4-2-5-18(14-17)26-22-23-8-3-9-24-22/h2-9,14,19H,10-13,15H2,1H3,(H,25,28)(H,23,24,26)