3-(4-bromanyl-3-methyl-pyrazol-1-yl)-1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-bromanyl-3-methyl-pyrazol-1-yl)-1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(4-bromo-3-methyl-1-pyrazolyl)-1-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-bromo-3-methylpyrazol-1-yl)-1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-1-(4-m-anisylpiperazino)propan-1-one Formula: C19H25BrN4O2 MolecularWeight: 421.3314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=NN(C=C1Br)CCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C19H25BrN4O2/c1-15-18(20)14-24(21-15)7-6-19(25)23-10-8-22(9-11-23)13-16-4-3-5-17(12-16)26-2/h3-5,12,14H,6-11,13H2,1-2H3