(2-tert-butyl-5-cyclopropyl-pyrazol-3-yl)-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-tert-butyl-5-cyclopropyl-pyrazol-3-yl)-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-tert-butyl-5-cyclopropyl-pyrazol-3-yl)-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-tert-butyl-5-cyclopropyl-3-pyrazolyl)-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-tert-butyl-5-cyclopropylpyrazol-3-yl)-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-tert-butyl-5-cyclopropyl-pyrazol-3-yl)-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]methanone Formula: C21H26ClFN4O3S MolecularWeight: 468.972543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=CC(=N1)C2CC2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC(C)(C)N1C(=CC(=N1)C2CC2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H26ClFN4O3S/c1-21(2,3)27-19(13-18(24-27)14-4-5-14)20(28)25-8-10-26(11-9-25)31(29,30)15-6-7-17(23)16(22)12-15/h6-7,12-14H,4-5,8-11H2,1-3H3