4-chloranyl-5-[(3-phenylmethoxyphenyl)methylamino]-2-propan-2-yl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[(3-phenylmethoxyphenyl)methylamino]-2-propan-2-yl-pyridazin-3-one Openeye Name: 5-[(3-benzyloxyphenyl)methylamino]-4-chloro-2-isopropyl-pyridazin-3-one CAS Name: 4-chloro-5-[(3-phenylmethoxyphenyl)methylamino]-2-propan-2-yl-3-pyridazinone IUPAC Name: 4-chloro-5-[(3-phenylmethoxyphenyl)methylamino]-2-propan-2-ylpyridazin-3-one Traditional Name: 5-[(3-benzoxybenzyl)amino]-4-chloro-2-isopropyl-pyridazin-3-one Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=C(C=N1)NCC2=CC(=CC=C2)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)N1C(=O)C(=C(C=N1)NCC2=CC(=CC=C2)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-15(2)25-21(26)20(22)19(13-24-25)23-12-17-9-6-10-18(11-17)27-14-16-7-4-3-5-8-16/h3-11,13,15,23H,12,14H2,1-2H3