[4-(phenylmethyl)sulfonylpiperazin-1-yl]-(5-phenyl-1H-pyrazol-4-yl)methanone

Systemtic Name: [4-(phenylmethyl)sulfonylpiperazin-1-yl]-(5-phenyl-1H-pyrazol-4-yl)methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(5-phenyl-1H-pyrazol-4-yl)methanone CAS Name: [4-(phenylmethyl)sulfonyl-1-piperazinyl]-(5-phenyl-1H-pyrazol-4-yl)methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(5-phenyl-1H-pyrazol-4-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(5-phenyl-1H-pyrazol-4-yl)methanone Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(NN=C2)C3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(NN=C2)C3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3S/c26-21(19-15-22-23-20(19)18-9-5-2-6-10-18)24-11-13-25(14-12-24)29(27,28)16-17-7-3-1-4-8-17/h1-10,15H,11-14,16H2,(H,22,23)