4-chloranyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-chloro-N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-thiazolyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]-3-piperidinosulfonyl-benzamide Formula: C22H30ClN4O3S2+ MolecularWeight: 498.0816

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H29ClN4O3S2/c1-16-7-11-26(12-8-16)14-18-15-31-22(24-18)25-21(28)17-5-6-19(23)20(13-17)32(29,30)27-9-3-2-4-10-27/h5-6,13,15-16H,2-4,7-12,14H2,1H3,(H,24,25,28)/p+1