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

Systemtic Name: [4-[[2-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amino]phenyl]-morpholin-4-yl-methanone Openeye Name: [4-[[2-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amino]phenyl]-morpholino-methanone CAS Name: [4-[[2-(1,3-benzodioxol-5-yl)-6-methyl-4-pyrimidinyl]amino]phenyl]-(4-morpholinyl)methanone IUPAC Name: [4-[[2-(1,3-benzodioxol-5-yl)-6-methylpyrimidin-4-yl]amino]phenyl]-morpholin-4-ylmethanone Traditional Name: [4-[[2-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amino]phenyl]-morpholino-methanone Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC3=C(C=C2)OCO3)NC4=CC=C(C=C4)C(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC3=C(C=C2)OCO3)NC4=CC=C(C=C4)C(=O)N5CCOCC5

InChI

InChI=1S/C23H22N4O4/c1-15-12-21(26-22(24-15)17-4-7-19-20(13-17)31-14-30-19)25-18-5-2-16(3-6-18)23(28)27-8-10-29-11-9-27/h2-7,12-13H,8-11,14H2,1H3,(H,24,25,26)