(E)-3-[(4,6-dimethylpyrimidin-2-yl)amino]-1-phenyl-but-2-en-1-one

Systemtic Name: (E)-3-[(4,6-dimethylpyrimidin-2-yl)amino]-1-phenyl-but-2-en-1-one Openeye Name: (E)-3-[(4,6-dimethylpyrimidin-2-yl)amino]-1-phenyl-but-2-en-1-one CAS Name: (E)-3-[(4,6-dimethyl-2-pyrimidinyl)amino]-1-phenyl-2-buten-1-one IUPAC Name: (E)-3-[(4,6-dimethylpyrimidin-2-yl)amino]-1-phenylbut-2-en-1-one Traditional Name: (E)-3-[(4,6-dimethylpyrimidin-2-yl)amino]-1-phenyl-but-2-en-1-one Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=CC(=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N/C(=C/C(=O)C2=CC=CC=C2)/C)C

InChI

InChI=1S/C16H17N3O/c1-11-9-12(2)18-16(17-11)19-13(3)10-15(20)14-7-5-4-6-8-14/h4-10H,1-3H3,(H,17,18,19)/b13-10+