3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[1-[4-(1-hydroxyethyl)-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-(1-hydroxyethyl)-3-methyl-2-methylimino-1,3-thiazol-5-yl]piperidin-1-ium-1-yl]propan-1-one Openeye Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-1-[1-[4-(1-hydroxyethyl)-3-methyl-2-methylimino-thiazol-5-yl]piperidin-1-ium-1-yl]propan-1-one CAS Name: 3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[1-[4-(1-hydroxyethyl)-3-methyl-2-methylimino-5-thiazolyl]-1-piperidin-1-iumyl]-1-propanone IUPAC Name: 3-(6-chloronaphthalen-2-yl)sulfonyl-1-[1-[4-(1-hydroxyethyl)-3-methyl-2-methylimino-1,3-thiazol-5-yl]piperidin-1-ium-1-yl]propan-1-one Traditional Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-1-[1-[4-(1-hydroxyethyl)-3-methyl-2-methylimino-4-thiazolin-5-yl]piperidin-1-ium-1-yl]propan-1-one Formula: C25H31ClN3O4S2+ MolecularWeight: 537.11434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31ClN3O4S2/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/h7-10,15-17,30H,4-6,11-14H2,1-3H3/q+1