1,3-benzodioxol-5-yl-[4-(2-methyl-6-morpholin-4-yl-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(2-methyl-6-morpholin-4-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(2-methyl-6-morpholino-pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(2-methyl-6-morpholino-pyrimidin-4-yl)piperazino]methanone Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCOCC2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCOCC2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H25N5O4/c1-15-22-19(13-20(23-15)25-8-10-28-11-9-25)24-4-6-26(7-5-24)21(27)16-2-3-17-18(12-16)30-14-29-17/h2-3,12-13H,4-11,14H2,1H3