3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-1-[4-(furan-3-ylcarbonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-1-[4-(furan-3-ylcarbonyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(furan-3-carbonyl)piperazin-1-yl]-3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propan-1-one CAS Name: 3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-1-[4-[3-furanyl(oxo)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-1-[4-(furan-3-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(3-furoyl)piperazino]-3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propan-1-one Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CCC(=O)N2CCN(CC2)C(=O)C3=COC=C3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CCC(=O)N2CCN(CC2)C(=O)C3=COC=C3

InChI

InChI=1S/C21H30N4O3/c1-15(2)13-25-17(4)19(16(3)22-25)5-6-20(26)23-8-10-24(11-9-23)21(27)18-7-12-28-14-18/h7,12,14-15H,5-6,8-11,13H2,1-4H3