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

Systemtic Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amino]benzamide Openeye Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amino]benzamide CAS Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-4-pyrimidinyl]amino]benzamide IUPAC Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methylpyrimidin-4-yl]amino]benzamide Traditional Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amino]benzamide Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC3=C(C=C2)OCO3)NC4=CC=CC=C4C(=O)N

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC3=C(C=C2)OCO3)NC4=CC=CC=C4C(=O)N

InChI

InChI=1S/C19H16N4O3/c1-11-8-17(22-14-5-3-2-4-13(14)18(20)24)23-19(21-11)12-6-7-15-16(9-12)26-10-25-15/h2-9H,10H2,1H3,(H2,20,24)(H,21,22,23)