(E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethyl-2-pyrimidinyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyrimidin-2-yl)acrylamide Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C16H15N3O3/c1-10-7-11(2)18-16(17-10)19-15(20)6-4-12-3-5-13-14(8-12)22-9-21-13/h3-8H,9H2,1-2H3,(H,17,18,19,20)/b6-4+