1-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-4-(3-methylimidazol-4-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 1-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-4-(3-methylimidazol-4-yl)piperidin-1-yl]propan-1-one Openeye Name: 1-[2-[(6-chloro-2-naphthyl)sulfonyl]-4-(3-methylimidazol-4-yl)-1-piperidyl]propan-1-one CAS Name: 1-[2-[(6-chloro-2-naphthalenyl)sulfonyl]-4-(3-methyl-4-imidazolyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-[2-(6-chloronaphthalen-2-yl)sulfonyl-4-(3-methylimidazol-4-yl)piperidin-1-yl]propan-1-one Traditional Name: 1-[2-[(6-chloro-2-naphthyl)sulfonyl]-4-(3-methylimidazol-4-yl)piperidino]propan-1-one Formula: C22H24ClN3O3S MolecularWeight: 445.96226

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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)Cl)C4=CN=CN4C

Isomeric SMILES

CCC(=O)N1CCC(CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CN=CN4C

InChI

InChI=1S/C22H24ClN3O3S/c1-3-21(27)26-9-8-17(20-13-24-14-25(20)2)12-22(26)30(28,29)19-7-5-15-10-18(23)6-4-16(15)11-19/h4-7,10-11,13-14,17,22H,3,8-9,12H2,1-2H3