[4-[5-[2-(methylamino)-6-pyridin-2-yl-pyridin-4-yl]pyridin-3-yl]phenyl]-piperazin-1-yl-methanone

Systemtic Name: [4-[5-[2-(methylamino)-6-pyridin-2-yl-pyridin-4-yl]pyridin-3-yl]phenyl]-piperazin-1-yl-methanone Openeye Name: [4-[5-[2-(methylamino)-6-(2-pyridyl)-4-pyridyl]-3-pyridyl]phenyl]-piperazin-1-yl-methanone CAS Name: [4-[5-[2-(methylamino)-6-(2-pyridinyl)-4-pyridinyl]-3-pyridinyl]phenyl]-(1-piperazinyl)methanone IUPAC Name: [4-[5-[2-(methylamino)-6-pyridin-2-ylpyridin-4-yl]pyridin-3-yl]phenyl]-piperazin-1-ylmethanone Traditional Name: [4-[5-[2-(methylamino)-6-(2-pyridyl)-4-pyridyl]-3-pyridyl]phenyl]-piperazino-methanone Formula: C27H26N6O MolecularWeight: 450.53494

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=CC(=N1)C2=CC=CC=N2)C3=CN=CC(=C3)C4=CC=C(C=C4)C(=O)N5CCNCC5

Isomeric SMILES

CNC1=CC(=CC(=N1)C2=CC=CC=N2)C3=CN=CC(=C3)C4=CC=C(C=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C27H26N6O/c1-28-26-16-21(15-25(32-26)24-4-2-3-9-31-24)23-14-22(17-30-18-23)19-5-7-20(8-6-19)27(34)33-12-10-29-11-13-33/h2-9,14-18,29H,10-13H2,1H3,(H,28,32)