4-[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(3,5-dibromo-2-hydroxy-phenyl)methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(3,5-dibromo-2-hydroxyphenyl)methylamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(3,5-dibromo-2-hydroxyphenyl)methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(3,5-dibromo-2-hydroxy-benzyl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C18H17Br2N3O2 MolecularWeight: 467.15448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCC3=CC(=CC(=C3O)Br)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCC3=CC(=CC(=C3O)Br)Br

InChI

InChI=1S/C18H17Br2N3O2/c1-11-16(21-10-12-8-13(19)9-15(20)17(12)24)18(25)23(22(11)2)14-6-4-3-5-7-14/h3-9,21,24H,10H2,1-2H3