5-[4-(5-methylpyrazin-2-yl)carbonylpiperazin-1-yl]-2-phenyl-4-phenylmethoxy-pyridazin-3-one

Systemtic Name: 5-[4-(5-methylpyrazin-2-yl)carbonylpiperazin-1-yl]-2-phenyl-4-phenylmethoxy-pyridazin-3-one Openeye Name: 4-benzyloxy-5-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[(5-methyl-2-pyrazinyl)-oxomethyl]-1-piperazinyl]-2-phenyl-4-phenylmethoxy-3-pyridazinone IUPAC Name: 5-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-yl]-2-phenyl-4-phenylmethoxypyridazin-3-one Traditional Name: 4-benzoxy-5-[4-(5-methylpyrazinoyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C27H26N6O3 MolecularWeight: 482.53374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H26N6O3/c1-20-16-29-23(17-28-20)26(34)32-14-12-31(13-15-32)24-18-30-33(22-10-6-3-7-11-22)27(35)25(24)36-19-21-8-4-2-5-9-21/h2-11,16-18H,12-15,19H2,1H3