2-[1-(5-fluoranyl-2-methoxy-phenyl)sulfonylpiperidin-3-yl]-5-(2-methylpropyl)-1,3,4-thiadiazole

Systemtic Name: 2-[1-(5-fluoranyl-2-methoxy-phenyl)sulfonylpiperidin-3-yl]-5-(2-methylpropyl)-1,3,4-thiadiazole Openeye Name: 2-[1-(5-fluoro-2-methoxy-phenyl)sulfonyl-3-piperidyl]-5-isobutyl-1,3,4-thiadiazole CAS Name: 2-[1-(5-fluoro-2-methoxyphenyl)sulfonyl-3-piperidinyl]-5-(2-methylpropyl)-1,3,4-thiadiazole IUPAC Name: 2-[1-(5-fluoro-2-methoxyphenyl)sulfonylpiperidin-3-yl]-5-(2-methylpropyl)-1,3,4-thiadiazole Traditional Name: 2-[1-(5-fluoro-2-methoxy-phenyl)sulfonyl-3-piperidyl]-5-isobutyl-1,3,4-thiadiazole Formula: C18H24FN3O3S2 MolecularWeight: 413.529863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)C2CCCN(C2)S(=O)(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC(C)CC1=NN=C(S1)C2CCCN(C2)S(=O)(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C18H24FN3O3S2/c1-12(2)9-17-20-21-18(26-17)13-5-4-8-22(11-13)27(23,24)16-10-14(19)6-7-15(16)25-3/h6-7,10,12-13H,4-5,8-9,11H2,1-3H3