2-tert-butyl-5-chloranyl-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]pyridazin-3-one

Systemtic Name: 2-tert-butyl-5-chloranyl-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]pyridazin-3-one Openeye Name: 2-tert-butyl-5-chloro-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]pyridazin-3-one CAS Name: 2-tert-butyl-5-chloro-4-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethylamino]-3-pyridazinone IUPAC Name: 2-tert-butyl-5-chloro-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]pyridazin-3-one Traditional Name: 2-tert-butyl-5-chloro-4-[2-[4-(2-methoxyphenyl)piperazino]ethylamino]pyridazin-3-one Formula: C21H30ClN5O2 MolecularWeight: 419.9482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)Cl)NCCN2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)Cl)NCCN2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H30ClN5O2/c1-21(2,3)27-20(28)19(16(22)15-24-27)23-9-10-25-11-13-26(14-12-25)17-7-5-6-8-18(17)29-4/h5-8,15,23H,9-14H2,1-4H3