[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]-(5-methyl-1,3-diphenyl-pyrazol-4-yl)methanone

Systemtic Name: [4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]-(5-methyl-1,3-diphenyl-pyrazol-4-yl)methanone Openeye Name: [4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]-(5-methyl-1,3-diphenyl-pyrazol-4-yl)methanone CAS Name: [4-[(1,3-dimethyl-4-pyrazolyl)methyl]-1-piperazinyl]-(5-methyl-1,3-diphenyl-4-pyrazolyl)methanone IUPAC Name: [4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]-(5-methyl-1,3-diphenylpyrazol-4-yl)methanone Traditional Name: [4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazino]-(5-methyl-1,3-diphenyl-pyrazol-4-yl)methanone Formula: C27H30N6O MolecularWeight: 454.5667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)N4CCN(CC4)CC5=CN(N=C5C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)N4CCN(CC4)CC5=CN(N=C5C)C

InChI

InChI=1S/C27H30N6O/c1-20-23(18-30(3)28-20)19-31-14-16-32(17-15-31)27(34)25-21(2)33(24-12-8-5-9-13-24)29-26(25)22-10-6-4-7-11-22/h4-13,18H,14-17,19H2,1-3H3