(E)-3-(dimethylamino)-1-(4-pyrimidin-2-yloxyphenyl)but-2-en-1-one

Systemtic Name: (E)-3-(dimethylamino)-1-(4-pyrimidin-2-yloxyphenyl)but-2-en-1-one Openeye Name: (E)-3-(dimethylamino)-1-(4-pyrimidin-2-yloxyphenyl)but-2-en-1-one CAS Name: (E)-3-(dimethylamino)-1-[4-(2-pyrimidinyloxy)phenyl]-2-buten-1-one IUPAC Name: (E)-3-(dimethylamino)-1-(4-pyrimidin-2-yloxyphenyl)but-2-en-1-one Traditional Name: (E)-3-(dimethylamino)-1-[4-(2-pyrimidyloxy)phenyl]but-2-en-1-one Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC=C(C=C1)OC2=NC=CC=N2)N(C)C

Isomeric SMILES

C/C(=C\C(=O)C1=CC=C(C=C1)OC2=NC=CC=N2)/N(C)C

InChI

InChI=1S/C16H17N3O2/c1-12(19(2)3)11-15(20)13-5-7-14(8-6-13)21-16-17-9-4-10-18-16/h4-11H,1-3H3/b12-11+