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

Systemtic Name: methyl 2-[5-chloranyl-4-[4-(dimethylcarbamoyl)piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]benzoate Openeye Name: methyl 2-[5-chloro-4-[4-(dimethylcarbamoyl)piperazin-1-yl]-6-oxo-pyridazin-1-yl]benzoate CAS Name: 2-[5-chloro-4-[4-[dimethylamino(oxo)methyl]-1-piperazinyl]-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-[4-(dimethylcarbamoyl)piperazin-1-yl]-6-oxopyridazin-1-yl]benzoate Traditional Name: 2-[5-chloro-4-[4-(dimethylcarbamoyl)piperazino]-6-keto-pyridazin-1-yl]benzoic acid methyl ester Formula: C19H22ClN5O4 MolecularWeight: 419.86208

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

Isomeric SMILES

CN(C)C(=O)N1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

InChI

InChI=1S/C19H22ClN5O4/c1-22(2)19(28)24-10-8-23(9-11-24)15-12-21-25(17(26)16(15)20)14-7-5-4-6-13(14)18(27)29-3/h4-7,12H,8-11H2,1-3H3