1-[2-(6-bromanylnaphthalen-2-yl)sulfonyl-4-(4-methylimidazol-1-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 1-[2-(6-bromanylnaphthalen-2-yl)sulfonyl-4-(4-methylimidazol-1-yl)piperidin-1-yl]propan-1-one Openeye Name: 1-[2-[(6-bromo-2-naphthyl)sulfonyl]-4-(4-methylimidazol-1-yl)-1-piperidyl]propan-1-one CAS Name: 1-[2-[(6-bromo-2-naphthalenyl)sulfonyl]-4-(4-methyl-1-imidazolyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-[2-(6-bromonaphthalen-2-yl)sulfonyl-4-(4-methylimidazol-1-yl)piperidin-1-yl]propan-1-one Traditional Name: 1-[2-[(6-bromo-2-naphthyl)sulfonyl]-4-(4-methylimidazol-1-yl)piperidino]propan-1-one Formula: C22H24BrN3O3S MolecularWeight: 490.41326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Br)N4C=C(N=C4)C

Isomeric SMILES

CCC(=O)N1CCC(CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Br)N4C=C(N=C4)C

InChI

InChI=1S/C22H24BrN3O3S/c1-3-21(27)26-9-8-19(25-13-15(2)24-14-25)12-22(26)30(28,29)20-7-5-16-10-18(23)6-4-17(16)11-20/h4-7,10-11,13-14,19,22H,3,8-9,12H2,1-2H3