3-[1-[(6-bromanyl-1H-benzimidazol-2-yl)sulfonyl]piperidin-2-yl]-5-(phenylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-[1-[(6-bromanyl-1H-benzimidazol-2-yl)sulfonyl]piperidin-2-yl]-5-(phenylmethyl)-1,2,4-oxadiazole Openeye Name: 5-benzyl-3-[1-[(6-bromo-1H-benzimidazol-2-yl)sulfonyl]-2-piperidyl]-1,2,4-oxadiazole CAS Name: 3-[1-[(6-bromo-1H-benzimidazol-2-yl)sulfonyl]-2-piperidinyl]-5-(phenylmethyl)-1,2,4-oxadiazole IUPAC Name: 5-benzyl-3-[1-[(6-bromo-1H-benzimidazol-2-yl)sulfonyl]piperidin-2-yl]-1,2,4-oxadiazole Traditional Name: 5-benzyl-3-[1-[(6-bromo-1H-benzimidazol-2-yl)sulfonyl]-2-piperidyl]-1,2,4-oxadiazole Formula: C21H20BrN5O3S MolecularWeight: 502.3842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NOC(=N2)CC3=CC=CC=C3)S(=O)(=O)C4=NC5=C(N4)C=C(C=C5)Br

Isomeric SMILES

C1CCN(C(C1)C2=NOC(=N2)CC3=CC=CC=C3)S(=O)(=O)C4=NC5=C(N4)C=C(C=C5)Br

InChI

InChI=1S/C21H20BrN5O3S/c22-15-9-10-16-17(13-15)24-21(23-16)31(28,29)27-11-5-4-8-18(27)20-25-19(30-26-20)12-14-6-2-1-3-7-14/h1-3,6-7,9-10,13,18H,4-5,8,11-12H2,(H,23,24)