3-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-[[2-(4-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazinyl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]-1H-pyridazin-6-one Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C(=O)C4=NNC(=O)C=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C(=O)C4=NNC(=O)C=C4

InChI

InChI=1S/C20H21N5O3S/c1-28-16-4-2-14(3-5-16)19-21-15(13-29-19)12-24-8-10-25(11-9-24)20(27)17-6-7-18(26)23-22-17/h2-7,13H,8-12H2,1H3,(H,23,26)