methyl 2-[5-chloranyl-4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]benzoate

Systemtic Name: methyl 2-[5-chloranyl-4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]benzoate Openeye Name: methyl 2-[5-chloro-4-[4-(m-tolylmethyl)piperazin-1-yl]-6-oxo-pyridazin-1-yl]benzoate CAS Name: 2-[5-chloro-4-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-6-oxopyridazin-1-yl]benzoate Traditional Name: 2-[5-chloro-6-keto-4-[4-(3-methylbenzyl)piperazino]pyridazin-1-yl]benzoic acid methyl ester Formula: C24H25ClN4O3 MolecularWeight: 452.9333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4C(=O)OC)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4C(=O)OC)Cl

InChI

InChI=1S/C24H25ClN4O3/c1-17-6-5-7-18(14-17)16-27-10-12-28(13-11-27)21-15-26-29(23(30)22(21)25)20-9-4-3-8-19(20)24(31)32-2/h3-9,14-15H,10-13,16H2,1-2H3