4-[[3-[(4-aminophenyl)methyl]-4-methoxy-phenyl]methyl-(2-oxidanylidene-2-piperazin-1-yl-ethoxy)amino]-5-chloranyl-3-propan-2-yloxy-1H-pyridazin-6-one

Systemtic Name: 4-[[3-[(4-aminophenyl)methyl]-4-methoxy-phenyl]methyl-(2-oxidanylidene-2-piperazin-1-yl-ethoxy)amino]-5-chloranyl-3-propan-2-yloxy-1H-pyridazin-6-one Openeye Name: 4-[[3-[(4-aminophenyl)methyl]-4-methoxy-phenyl]methyl-(2-oxo-2-piperazin-1-yl-ethoxy)amino]-5-chloro-3-isopropoxy-1H-pyridazin-6-one CAS Name: 4-[[3-[(4-aminophenyl)methyl]-4-methoxyphenyl]methyl-[2-oxo-2-(1-piperazinyl)ethoxy]amino]-5-chloro-3-propan-2-yloxy-1H-pyridazin-6-one IUPAC Name: 4-[[3-[(4-aminophenyl)methyl]-4-methoxyphenyl]methyl-(2-oxo-2-piperazin-1-ylethoxy)amino]-5-chloro-3-propan-2-yloxy-1H-pyridazin-6-one Traditional Name: 4-[[3-(4-aminobenzyl)-4-methoxy-benzyl]-(2-keto-2-piperazino-ethoxy)amino]-5-chloro-3-isopropoxy-1H-pyridazin-6-one Formula: C28H35ClN6O5 MolecularWeight: 571.0677

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NNC(=O)C(=C1N(CC2=CC(=C(C=C2)OC)CC3=CC=C(C=C3)N)OCC(=O)N4CCNCC4)Cl

Isomeric SMILES

CC(C)OC1=NNC(=O)C(=C1N(CC2=CC(=C(C=C2)OC)CC3=CC=C(C=C3)N)OCC(=O)N4CCNCC4)Cl

InChI

InChI=1S/C28H35ClN6O5/c1-18(2)40-28-26(25(29)27(37)32-33-28)35(39-17-24(36)34-12-10-31-11-13-34)16-20-6-9-23(38-3)21(15-20)14-19-4-7-22(30)8-5-19/h4-9,15,18,31H,10-14,16-17,30H2,1-3H3,(H,32,37)