3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propan-1-one CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(4-bromo-3,5-dimethylpyrazol-1-yl)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propan-1-one Formula: C19H25BrN4O MolecularWeight: 405.332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C)Br

InChI

InChI=1S/C19H25BrN4O/c1-15-19(20)16(2)24(21-15)9-8-18(25)23-12-10-22(11-13-23)14-17-6-4-3-5-7-17/h3-7H,8-14H2,1-2H3