4-[[(E)-[3-(4-bromophenyl)pyrazol-4-ylidene]methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[(E)-[3-(4-bromophenyl)pyrazol-4-ylidene]methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[(E)-[3-(4-bromophenyl)pyrazol-4-ylidene]methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[(E)-[3-(4-bromophenyl)-4-pyrazolylidene]methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[(E)-[3-(4-bromophenyl)pyrazol-4-ylidene]methyl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[(E)-[3-(4-bromophenyl)pyrazol-4-ylidene]methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C21H18BrN5O MolecularWeight: 436.30452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C=NN=C3C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N/C=C/3\C=NN=C3C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H18BrN5O/c1-14-19(21(28)27(26(14)2)18-6-4-3-5-7-18)23-12-16-13-24-25-20(16)15-8-10-17(22)11-9-15/h3-13,23H,1-2H3/b16-12+