5-[1-(4-bromanyl-3-methyl-phenyl)sulfonylpiperidin-4-yl]-1,3,4-oxadiazol-2-amine

Systemtic Name: 5-[1-(4-bromanyl-3-methyl-phenyl)sulfonylpiperidin-4-yl]-1,3,4-oxadiazol-2-amine Openeye Name: 5-[1-(4-bromo-3-methyl-phenyl)sulfonyl-4-piperidyl]-1,3,4-oxadiazol-2-amine CAS Name: 5-[1-(4-bromo-3-methylphenyl)sulfonyl-4-piperidinyl]-1,3,4-oxadiazol-2-amine IUPAC Name: 5-[1-(4-bromo-3-methylphenyl)sulfonylpiperidin-4-yl]-1,3,4-oxadiazol-2-amine Traditional Name: [5-[1-(4-bromo-3-methyl-phenyl)sulfonyl-4-piperidyl]-1,3,4-oxadiazol-2-yl]amine Formula: C14H17BrN4O3S MolecularWeight: 401.27878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(CC2)C3=NN=C(O3)N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(CC2)C3=NN=C(O3)N)Br

InChI

InChI=1S/C14H17BrN4O3S/c1-9-8-11(2-3-12(9)15)23(20,21)19-6-4-10(5-7-19)13-17-18-14(16)22-13/h2-3,8,10H,4-7H2,1H3,(H2,16,18)