3-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-(5-bromo-2-methoxy-phenyl)sulfonyl-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-(5-bromo-2-methoxyphenyl)sulfonyl-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-(5-bromo-2-methoxyphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-(5-bromo-2-methoxy-phenyl)sulfonyl-4-piperidyl]-1H-benzimidazol-2-one Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C19H20BrN3O4S/c1-27-17-7-6-13(20)12-18(17)28(25,26)22-10-8-14(9-11-22)23-16-5-3-2-4-15(16)21-19(23)24/h2-7,12,14H,8-11H2,1H3,(H,21,24)