1-[1-(2-azanyl-1,3-thiazol-5-yl)piperidin-1-ium-1-yl]-3-(6-chloranylnaphthalen-2-yl)sulfonyl-propan-1-one

Systemtic Name: 1-[1-(2-azanyl-1,3-thiazol-5-yl)piperidin-1-ium-1-yl]-3-(6-chloranylnaphthalen-2-yl)sulfonyl-propan-1-one Openeye Name: 1-[1-(2-aminothiazol-5-yl)piperidin-1-ium-1-yl]-3-[(6-chloro-2-naphthyl)sulfonyl]propan-1-one CAS Name: 1-[1-(2-amino-5-thiazolyl)-1-piperidin-1-iumyl]-3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-propanone IUPAC Name: 1-[1-(2-amino-1,3-thiazol-5-yl)piperidin-1-ium-1-yl]-3-(6-chloronaphthalen-2-yl)sulfonylpropan-1-one Traditional Name: 1-[1-(2-aminothiazol-5-yl)piperidin-1-ium-1-yl]-3-[(6-chloro-2-naphthyl)sulfonyl]propan-1-one Formula: C21H23ClN3O3S2+ MolecularWeight: 465.00862

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(C2=CN=C(S2)N)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

C1CC[N+](CC1)(C2=CN=C(S2)N)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN3O3S2/c22-17-6-4-16-13-18(7-5-15(16)12-17)30(27,28)11-8-19(26)25(9-2-1-3-10-25)20-14-24-21(23)29-20/h4-7,12-14H,1-3,8-11H2,(H2,23,24)/q+1