2-[(E)-2-phenylethenyl]-4-(4-pyridin-4-ylpiperazin-1-yl)pyrimidine

Systemtic Name: 2-[(E)-2-phenylethenyl]-4-(4-pyridin-4-ylpiperazin-1-yl)pyrimidine Openeye Name: 4-[4-(4-pyridyl)piperazin-1-yl]-2-[(E)-styryl]pyrimidine CAS Name: 2-[(E)-2-phenylethenyl]-4-(4-pyridin-4-yl-1-piperazinyl)pyrimidine IUPAC Name: 2-[(E)-2-phenylethenyl]-4-(4-pyridin-4-ylpiperazin-1-yl)pyrimidine Traditional Name: 4-[4-(4-pyridyl)piperazino]-2-[(E)-styryl]pyrimidine Formula: C21H21N5 MolecularWeight: 343.42494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C3=NC(=NC=C3)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C3=NC(=NC=C3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C21H21N5/c1-2-4-18(5-3-1)6-7-20-23-13-10-21(24-20)26-16-14-25(15-17-26)19-8-11-22-12-9-19/h1-13H,14-17H2/b7-6+