[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-[5-(2-furyl)-2-phenyl-pyrazol-3-yl]methanone CAS Name: [5-(2-furanyl)-2-phenyl-3-pyrazolyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-[5-(furan-2-yl)-2-phenylpyrazol-3-yl]methanone Traditional Name: (4-benzylsulfonylpiperazino)-[5-(2-furyl)-2-phenyl-pyrazol-3-yl]methanone Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CO4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CO4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N4O4S/c30-25(27-13-15-28(16-14-27)34(31,32)19-20-8-3-1-4-9-20)23-18-22(24-12-7-17-33-24)26-29(23)21-10-5-2-6-11-21/h1-12,17-18H,13-16,19H2