2-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-thiophen-2-yl-pyridazin-3-one

Systemtic Name: 2-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-butyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[4-[4-(4-methoxyphenyl)-1-piperazinyl]-4-oxobutyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[4-keto-4-[4-(4-methoxyphenyl)piperazino]butyl]-6-(2-thienyl)pyridazin-3-one Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C23H26N4O3S/c1-30-19-8-6-18(7-9-19)25-13-15-26(16-14-25)22(28)5-2-12-27-23(29)11-10-20(24-27)21-4-3-17-31-21/h3-4,6-11,17H,2,5,12-16H2,1H3