(2S)-2-(4-bromanylpyrazol-1-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: (2S)-2-(4-bromanylpyrazol-1-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one Openeye Name: (2S)-2-(4-bromopyrazol-1-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one CAS Name: (2S)-2-(4-bromo-1-pyrazolyl)-1-[4-(4-methoxyphenyl)-1-piperazinyl]-1-propanone IUPAC Name: (2S)-2-(4-bromopyrazol-1-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one Traditional Name: (2S)-2-(4-bromopyrazol-1-yl)-1-[4-(4-methoxyphenyl)piperazino]propan-1-one Formula: C17H21BrN4O2 MolecularWeight: 393.27824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)N3C=C(C=N3)Br

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)N3C=C(C=N3)Br

InChI

InChI=1S/C17H21BrN4O2/c1-13(22-12-14(18)11-19-22)17(23)21-9-7-20(8-10-21)15-3-5-16(24-2)6-4-15/h3-6,11-13H,7-10H2,1-2H3/t13-/m0/s1