3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[1-(3-methyl-2-methylimino-1,3-thiazol-4-yl)piperidin-1-ium-1-yl]propan-1-one

Systemtic Name: 3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[1-(3-methyl-2-methylimino-1,3-thiazol-4-yl)piperidin-1-ium-1-yl]propan-1-one Openeye Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-1-[1-(3-methyl-2-methylimino-thiazol-4-yl)piperidin-1-ium-1-yl]propan-1-one CAS Name: 3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[1-(3-methyl-2-methylimino-4-thiazolyl)-1-piperidin-1-iumyl]-1-propanone IUPAC Name: 3-(6-chloronaphthalen-2-yl)sulfonyl-1-[1-(3-methyl-2-methylimino-1,3-thiazol-4-yl)piperidin-1-ium-1-yl]propan-1-one Traditional Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-1-[1-(3-methyl-2-methylimino-4-thiazolin-4-yl)piperidin-1-ium-1-yl]propan-1-one Formula: C23H27ClN3O3S2+ MolecularWeight: 493.06178

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C(=CS1)[N+]2(CCCCC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C

Isomeric SMILES

CN=C1N(C(=CS1)[N+]2(CCCCC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C

InChI

InChI=1S/C23H27ClN3O3S2/c1-25-23-26(2)21(16-31-23)27(11-4-3-5-12-27)22(28)10-13-32(29,30)20-9-7-17-14-19(24)8-6-18(17)15-20/h6-9,14-16H,3-5,10-13H2,1-2H3/q+1