1-[3-[4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]piperazino]sulfonylphenyl]ethanone Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H25ClN4O3S/c1-17-22(23(24)28(25-17)20-8-4-3-5-9-20)16-26-11-13-27(14-12-26)32(30,31)21-10-6-7-19(15-21)18(2)29/h3-10,15H,11-14,16H2,1-2H3