2-[2-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[2-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[2-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[2-[4-(2,4-diethoxyphenyl)sulfonyl-1-piperazinyl]ethyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[2-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-phenylpyridazin-3-one Traditional Name: 2-[2-[4-(2,4-diethoxyphenyl)sulfonylpiperazino]ethyl]-6-phenyl-pyridazin-3-one Formula: C26H32N4O5S MolecularWeight: 512.62108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C26H32N4O5S/c1-3-34-22-10-12-25(24(20-22)35-4-2)36(32,33)29-17-14-28(15-18-29)16-19-30-26(31)13-11-23(27-30)21-8-6-5-7-9-21/h5-13,20H,3-4,14-19H2,1-2H3