2-tert-butyl-4-[[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-tert-butyl-4-[[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole Openeye Name: 2-tert-butyl-4-[[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]methyl]thiazole CAS Name: 2-tert-butyl-4-[[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]methyl]thiazole IUPAC Name: 2-tert-butyl-4-[[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole Traditional Name: 2-tert-butyl-4-[[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]methyl]thiazole Formula: C18H23ClFN3O2S2 MolecularWeight: 431.975523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CS1)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C)(C)C1=NC(=CS1)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H23ClFN3O2S2/c1-18(2,3)17-21-13(12-26-17)11-22-6-8-23(9-7-22)27(24,25)14-4-5-16(20)15(19)10-14/h4-5,10,12H,6-9,11H2,1-3H3