5-azanyl-2-[(3-bromophenyl)methyl]-4-methyl-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[(3-bromophenyl)methyl]-4-methyl-1H-pyrazol-3-one Openeye Name: 5-amino-2-[(3-bromophenyl)methyl]-4-methyl-1H-pyrazol-3-one CAS Name: 5-amino-2-[(3-bromophenyl)methyl]-4-methyl-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[(3-bromophenyl)methyl]-4-methyl-1H-pyrazol-3-one Traditional Name: 5-amino-2-(3-bromobenzyl)-4-methyl-3-pyrazolin-3-one Formula: C11H12BrN3O MolecularWeight: 282.13648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)CC2=CC(=CC=C2)Br)N

Isomeric SMILES

CC1=C(NN(C1=O)CC2=CC(=CC=C2)Br)N

InChI

InChI=1S/C11H12BrN3O/c1-7-10(13)14-15(11(7)16)6-8-3-2-4-9(12)5-8/h2-5,14H,6,13H2,1H3