(E)-1-[4-(2-phenylpyrimidin-4-yl)piperidin-1-yl]-3-pyridin-4-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(2-phenylpyrimidin-4-yl)piperidin-1-yl]-3-pyridin-4-yl-prop-2-en-1-one Openeye Name: (E)-1-[4-(2-phenylpyrimidin-4-yl)-1-piperidyl]-3-(4-pyridyl)prop-2-en-1-one CAS Name: (E)-1-[4-(2-phenyl-4-pyrimidinyl)-1-piperidinyl]-3-pyridin-4-yl-2-propen-1-one IUPAC Name: (E)-1-[4-(2-phenylpyrimidin-4-yl)piperidin-1-yl]-3-pyridin-4-ylprop-2-en-1-one Traditional Name: (E)-1-[4-(2-phenylpyrimidin-4-yl)piperidino]-3-(4-pyridyl)prop-2-en-1-one Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=NC=C2)C3=CC=CC=C3)C(=O)C=CC4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1C2=NC(=NC=C2)C3=CC=CC=C3)C(=O)/C=C/C4=CC=NC=C4

InChI

InChI=1S/C23H22N4O/c28-22(7-6-18-8-13-24-14-9-18)27-16-11-19(12-17-27)21-10-15-25-23(26-21)20-4-2-1-3-5-20/h1-10,13-15,19H,11-12,16-17H2/b7-6+