3-azanyl-4-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-2-phenyl-1H-pyrazol-5-one

Systemtic Name: 3-azanyl-4-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-2-phenyl-1H-pyrazol-5-one Openeye Name: 3-amino-4-[2-(4-bromophenyl)-2-oxo-ethyl]-2-phenyl-1H-pyrazol-5-one CAS Name: 3-amino-4-[2-(4-bromophenyl)-2-oxoethyl]-2-phenyl-1H-pyrazol-5-one IUPAC Name: 3-amino-4-[2-(4-bromophenyl)-2-oxoethyl]-2-phenyl-1H-pyrazol-5-one Traditional Name: 5-amino-4-[2-(4-bromophenyl)-2-keto-ethyl]-1-phenyl-3-pyrazolin-3-one Formula: C17H14BrN3O2 MolecularWeight: 372.21596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=O)N2)CC(=O)C3=CC=C(C=C3)Br)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=O)N2)CC(=O)C3=CC=C(C=C3)Br)N

InChI

InChI=1S/C17H14BrN3O2/c18-12-8-6-11(7-9-12)15(22)10-14-16(19)21(20-17(14)23)13-4-2-1-3-5-13/h1-9H,10,19H2,(H,20,23)