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

Systemtic Name: 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonyl-2-methyl-phthalazin-1-one Openeye Name: 4-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]-2-methyl-phthalazin-1-one CAS Name: 4-[[4-[[2-(4-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazinyl]-oxomethyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazine-1-carbonyl]-2-methylphthalazin-1-one Traditional Name: 4-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]-2-methyl-phthalazin-1-one Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC4=CSC(=N4)C5=CC=C(C=C5)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC4=CSC(=N4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C25H25N5O3S/c1-28-24(31)21-6-4-3-5-20(21)22(27-28)25(32)30-13-11-29(12-14-30)15-18-16-34-23(26-18)17-7-9-19(33-2)10-8-17/h3-10,16H,11-15H2,1-2H3