2-[2-[4-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperazin-1-yl]ethyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[2-[4-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperazin-1-yl]ethyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[2-[4-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperazin-1-yl]ethyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[2-[4-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]-1-piperazinyl]ethyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[2-[4-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperazin-1-yl]ethyl]-6-phenylpyridazin-3-one Traditional Name: 2-[2-[4-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperazino]ethyl]-6-phenyl-pyridazin-3-one Formula: C27H31N5O4S MolecularWeight: 521.63114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)CCN4C(=O)C=CC(=N4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)CCN4C(=O)C=CC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5O4S/c1-21(33)31-13-5-8-23-20-24(9-11-26(23)31)37(35,36)30-17-14-29(15-18-30)16-19-32-27(34)12-10-25(28-32)22-6-3-2-4-7-22/h2-4,6-7,9-12,20H,5,8,13-19H2,1H3