3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[1-(4-ethanoyl-3-methyl-2-methylimino-1,3-thiazol-5-yl)piperidin-1-ium-1-yl]propan-1-one

Systemtic Name: 3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[1-(4-ethanoyl-3-methyl-2-methylimino-1,3-thiazol-5-yl)piperidin-1-ium-1-yl]propan-1-one Openeye Name: 1-[1-(4-acetyl-3-methyl-2-methylimino-thiazol-5-yl)piperidin-1-ium-1-yl]-3-[(6-chloro-2-naphthyl)sulfonyl]propan-1-one CAS Name: 1-[1-(4-acetyl-3-methyl-2-methylimino-5-thiazolyl)-1-piperidin-1-iumyl]-3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-propanone IUPAC Name: 1-[1-(4-acetyl-3-methyl-2-methylimino-1,3-thiazol-5-yl)piperidin-1-ium-1-yl]-3-(6-chloronaphthalen-2-yl)sulfonylpropan-1-one Traditional Name: 1-[1-(4-acetyl-3-methyl-2-methylimino-4-thiazolin-5-yl)piperidin-1-ium-1-yl]-3-[(6-chloro-2-naphthyl)sulfonyl]propan-1-one Formula: C25H29ClN3O4S2+ MolecularWeight: 535.09846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(SC(=NC)N1C)[N+]2(CCCCC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC(=O)C1=C(SC(=NC)N1C)[N+]2(CCCCC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C25H29ClN3O4S2/c1-17(30)23-24(34-25(27-2)28(23)3)29(12-5-4-6-13-29)22(31)11-14-35(32,33)21-10-8-18-15-20(26)9-7-19(18)16-21/h7-10,15-16H,4-6,11-14H2,1-3H3/q+1