3-[3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]-5-(trifluoromethyl)-1,2-oxazole

Systemtic Name: 3-[3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]-5-(trifluoromethyl)-1,2-oxazole Openeye Name: 3-[3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]-5-(trifluoromethyl)isoxazole CAS Name: 3-[3-[(4-cyclohexyl-1-piperazinyl)sulfonyl]-4-methoxyphenyl]-5-(trifluoromethyl)isoxazole IUPAC Name: 3-[3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-methoxyphenyl]-5-(trifluoromethyl)-1,2-oxazole Traditional Name: 3-[3-(4-cyclohexylpiperazino)sulfonyl-4-methoxy-phenyl]-5-(trifluoromethyl)isoxazole Formula: C21H26F3N3O4S MolecularWeight: 473.50905

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=C2)C(F)(F)F)S(=O)(=O)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=C2)C(F)(F)F)S(=O)(=O)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C21H26F3N3O4S/c1-30-18-8-7-15(17-14-20(31-25-17)21(22,23)24)13-19(18)32(28,29)27-11-9-26(10-12-27)16-5-3-2-4-6-16/h7-8,13-14,16H,2-6,9-12H2,1H3